DT-Web

DB04322 - LY249543


Identification
Name LY249543
Accession Number DB04322 (EXPT01990)
Type small molecule
Description Not Available
Structure
MOL SDF PDB SMILES InChI
Categories (*)
Molecular Weight 443.4531
Groups experimental
Monoisotopic Weight 443.180483557
Pharmacology
Indication Not Available
Mechanism of action Not Available
Absorption Not Available
Protein binding Not Available
Biotransformation Not Available
Route of elimination Not Available
Toxicity Not Available
Affected organisms Not Available
Interactions
Drug Interactions Not Available
Food Interactions Not Available

Targets


C-1-tetrahydrofolate synthase, cytoplasmic
Name C-1-tetrahydrofolate synthase, cytoplasmic
Gene Name MTHFD1
Pharmacological action unknown
Actions Not Available
References
  • Overington JP, Al-Lazikani B, Hopkins AL: How many drug targets are there? Nat Rev Drug Discov. 2006 Dec;5(12):993-6. - Pubmed
  • Imming P, Sinning C, Meyer A: Drugs, their targets and the nature and number of drug targets. Nat Rev Drug Discov. 2006 Oct;5(10):821-34. - Pubmed
DTHybrid score 0.7075

Predictions


Id Partner name Gene Name Score
3920 Methylenetetrahydrofolate reductase intermediate form MTHFR 0.0185
3763 5,10-methylenetetrahydrofolate reductase metF 0.0185
3918 5,10-methylenetetrahydrofolate reductase MTHFR 0.0185
5094 5,10-methylenetetrahydrofolate reductase metF 0.0185
59 AMT protein AMT 0.0185
3919 Methionyl-tRNA formyltransferase, mitochondrial MTFMT 0.0185
1202 10-formyltetrahydrofolate dehydrogenase ALDH1L1 0.0185
296 Bifunctional methylenetetrahydrofolate dehydrogenase/cyclohydrolase, mitochondrial MTHFD2 0.0182
13 Aminomethyltransferase, mitochondrial AMT 0.018
914 Formimidoyltransferase-cyclodeaminase FTCD 0.0138
2287 Bifunctional purine biosynthesis protein PURH [Includes: Phosphoribosylaminoimidazolecarboxamide formyltransferase ATIC 0.0133
3884 SHMT2 protein SHMT2 0.0131
3901 SHMT2 protein SHMT2 0.0131
3885 Hypothetical protein DKFZp686P09201 DKFZp686P09201 0.0131
3879 Serine hydroxymethyltransferase 2 Not Available 0.0131
321 Serine hydroxymethyltransferase, mitochondrial SHMT2 0.0131
367 Serine hydroxymethyltransferase, cytosolic SHMT1 0.0126
809 Methionine synthase MTR 0.0122
2935 Methionine synthase metH 0.0122
3917 Methylenetetrahydrofolate reductase MTHFR 0.0106
635 Estradiol 17-beta-dehydrogenase 8 HSD17B8 0.008
666 NADP-dependent malic enzyme ME1 0.008
646 Malate dehydrogenase, cytoplasmic MDH1 0.0079
11 NAD(P) transhydrogenase, mitochondrial NNT 0.0076
3772 3-oxoacyl-[acyl-carrier-protein] reductase fabG 0.0072
5326 Oxidoreductase, short chain dehydrogenase/reductase family TM_0441 0.0072
5157 Dehydrogenase/reductase SDR family member 11 DHRS11 0.0072
5346 Oxidoreductase, aldo/keto reductase family TM_1009 0.0072
5332 MtdA bifunctional protein mtdA 0.0072
3778 NAD(P) transhydrogenase subunit beta pntB 0.0072
5322 Oxidoreductase ydhF ydhF 0.0072
4403 Protein iolS iolS 0.0072
5330 General stress protein 69 yhdN 0.0072
5333 Alcohol dehydrogenase, iron-containing TM_0920 0.0072
5342 NADH-dependent butanol dehydrogenase, putative TM_0820 0.0072
5343 NADP-dependent fatty aldehyde dehydrogenase aldH 0.0072
1735 Canalicular multispecific organic anion transporter 1 ABCC2 0.0069
6861 Alcohol dehydrogenase [NADP+] AKR1A1 0.0067
4484 2,5-diketo-D-gluconic acid reductase A dkgA 0.0067
686 Aldo-keto reductase family 1 member C2 AKR1C2 0.0066
2375 ADP-L-glycero-D-manno-heptose-6-epimerase hldD 0.0063
5073 Ferredoxin--NADP reductase petH 0.0063
5076 Ferredoxin--NADP reductase fpr 0.0063
5119 Ferredoxin--NADP reductase petH 0.0063
5121 Ferredoxin--NADP reductase fpr 0.0063
5075 Sulfite reductase [NADPH] flavoprotein alpha-component cysJ 0.0063
654 Flavin reductase BLVRB 0.0062
4582 Putative pteridine reductase 2 ptr2 0.0062
4628 NADP-dependent glyceraldehyde-3-phosphate dehydrogenase gapN 0.0061
2305 Isocitrate dehydrogenase [NADP] cytoplasmic IDH1 0.0061
5328 Prostaglandin F synthase Tb11.02.2310 0.0061
989 L-xylulose reductase DCXR 0.0061
1799 Glucose-6-phosphate 1-dehydrogenase G6PD 0.0061
2630 Glucose-6-phosphate 1-dehydrogenase zwf 0.0061
2286 Isocitrate dehydrogenase [NADP] icd 0.0061
2302 Isocitrate dehydrogenase [NADP] icd 0.0061
2771 Isocitrate dehydrogenase [NADP] icd 0.0061
2636 Shikimate dehydrogenase aroE 0.0061
3515 Shikimate dehydrogenase aroE 0.0061
3446 NADP-dependent alcohol dehydrogenase adh 0.0061
139 Aldo-keto reductase family 1 member C1 AKR1C1 0.0059
217 Estradiol 17-beta-dehydrogenase 1 HSD17B1 0.0058
444 Alcohol dehydrogenase 1B ADH1B 0.0057
6297 Prostaglandin reductase 1 PTGR1 0.0056
6862 Aldo-keto reductase family 1 member B10 AKR1B10 0.0056
3062 Aspartate-semialdehyde dehydrogenase asd 0.0056
4531 Putative ketoacyl reductase actIII 0.0056
650 Aldo-keto reductase family 1 member C3 AKR1C3 0.0056
5325 2,4-dienoyl-CoA reductase, mitochondrial DECR1 0.0055
2675 Pteridine reductase 1 PTR1 0.0054
3573 2,4-dienoyl-CoA reductase [NADPH] fadH 0.0054
2159 Quinone oxidoreductase CRYZ 0.0053
1124 Sepiapterin reductase SPR 0.0053
364 Corticosteroid 11-beta-dehydrogenase isozyme 1 HSD11B1 0.0053
631 3-hydroxy-3-methylglutaryl-coenzyme A reductase HMGCR 0.0049
3387 3-hydroxy-3-methylglutaryl-coenzyme A reductase mvaA 0.0049
822 Aldose reductase AKR1B1 0.0048
365 Dihydrofolate reductase DHFR 0.0047
2381 Dihydrofolate reductase DFR1 0.0047
2833 Dihydrofolate reductase Not Available 0.0047
2931 Dihydrofolate reductase folA 0.0047
3544 Dihydrofolate reductase folA 0.0047
3682 Dihydrofolate reductase folA 0.0047
6642 Dihydrofolate reductase folA 0.0047
6756 Dihydrofolate reductase dfrA 0.0047
76 Nitric-oxide synthase, brain NOS1 0.0036
4120 NADPH--cytochrome P450 reductase POR 0.0035
316 4-trimethylaminobutyraldehyde dehydrogenase ALDH9A1 0.0024
816 Biliverdin reductase A BLVRA 0.0024
579 Alcohol dehydrogenase class 4 mu/sigma chain ADH7 0.0024
792 Aldehyde dehydrogenase, dimeric NADP-preferring ALDH3A1 0.0024
374 NADH dehydrogenase [ubiquinone] 1 beta subcomplex subunit 1 NDUFB1 0.0024
190 NADH dehydrogenase [ubiquinone] 1 alpha subcomplex subunit 4 NDUFA4 0.0024
313 NADH dehydrogenase [ubiquinone] 1 beta subcomplex subunit 3 NDUFB3 0.0024
300 NADH-ubiquinone oxidoreductase chain 4L MT-ND4L 0.0024
475 NADH dehydrogenase [ubiquinone] 1 beta subcomplex subunit 2, mitochondrial NDUFB2 0.0024
99 NADH dehydrogenase [ubiquinone] iron-sulfur protein 5 NDUFS5 0.0024
30 NADH dehydrogenase [ubiquinone] flavoprotein 3, mitochondrial NDUFV3 0.0024
384 NADH-ubiquinone oxidoreductase chain 6 MT-ND6 0.0024
446 NADH dehydrogenase [ubiquinone] 1 alpha subcomplex subunit 7 NDUFA7 0.0024
525 NADH dehydrogenase [ubiquinone] 1 alpha subcomplex subunit 5 NDUFA5 0.0024
219 NADH-ubiquinone oxidoreductase chain 3 MT-ND3 0.0024
247 NADH dehydrogenase [ubiquinone] 1 alpha subcomplex subunit 1 NDUFA1 0.0024
417 NADH dehydrogenase [ubiquinone] 1 beta subcomplex subunit 6 NDUFB6 0.0024
324 NADH dehydrogenase [ubiquinone] 1 beta subcomplex subunit 4 NDUFB4 0.0024
41 NADH dehydrogenase [ubiquinone] iron-sulfur protein 8, mitochondrial NDUFS8 0.0024
343 NADH dehydrogenase [ubiquinone] 1 subunit C1, mitochondrial NDUFC1 0.0024
568 NADH dehydrogenase [ubiquinone] 1 beta subcomplex subunit 7 NDUFB7 0.0024
582 NADH dehydrogenase [ubiquinone] 1 alpha subcomplex subunit 13 NDUFA13 0.0024
829 NADH dehydrogenase [ubiquinone] 1 alpha subcomplex subunit 12 NDUFA12 0.0024
755 NADH dehydrogenase [ubiquinone] 1 alpha subcomplex subunit 3 NDUFA3 0.0024
353 NADH dehydrogenase [ubiquinone] 1 alpha subcomplex subunit 4-like 2 NDUFA4L2 0.0024
602 Acyl carrier protein, mitochondrial NDUFAB1 0.0024
104 NADH dehydrogenase [ubiquinone] iron-sulfur protein 6, mitochondrial NDUFS6 0.0024
555 NADH dehydrogenase [ubiquinone] iron-sulfur protein 4, mitochondrial NDUFS4 0.0024
405 NADH dehydrogenase [ubiquinone] 1 alpha subcomplex subunit 8 NDUFA8 0.0024
607 NADH dehydrogenase [ubiquinone] 1 alpha subcomplex subunit 2 NDUFA2 0.0024
598 NADH dehydrogenase [ubiquinone] 1 alpha subcomplex subunit 11 NDUFA11 0.0024
746 NADH dehydrogenase [ubiquinone] 1 beta subcomplex subunit 8, mitochondrial NDUFB8 0.0024
270 NADH dehydrogenase [ubiquinone] 1 beta subcomplex subunit 5, mitochondrial NDUFB5 0.0024
141 3-hydroxyisobutyrate dehydrogenase, mitochondrial HIBADH 0.0024
196 D-beta-hydroxybutyrate dehydrogenase, mitochondrial BDH1 0.0024
231 Glycerol-3-phosphate dehydrogenase [NAD+], cytoplasmic GPD1 0.0024
236 NADH dehydrogenase [ubiquinone] 1 alpha subcomplex subunit 6 NDUFA6 0.0024
656 NADH dehydrogenase [ubiquinone] 1 beta subcomplex subunit 9 NDUFB9 0.0024
14 Isocitrate dehydrogenase [NAD] subunit alpha, mitochondrial IDH3A 0.0024
152 NADH dehydrogenase [ubiquinone] flavoprotein 2, mitochondrial NDUFV2 0.0024
609 15-hydroxyprostaglandin dehydrogenase [NAD+] HPGD 0.0024
91 NADH dehydrogenase [ubiquinone] 1 alpha subcomplex subunit 10, mitochondrial NDUFA10 0.0024
107 C-4 methylsterol oxidase SC4MOL 0.0024
112 L-lactate dehydrogenase A-like 6B LDHAL6B 0.0024
272 NADH dehydrogenase [ubiquinone] 1 beta subcomplex subunit 10 NDUFB10 0.0024
372 Estradiol 17-beta-dehydrogenase 3 HSD17B3 0.0024
644 Heme oxygenase 2 HMOX2 0.0024
4982 Heme oxygenase 2 pbsA2 0.0024
729 GDP-L-fucose synthetase TSTA3 0.0024
3463 GDP-L-fucose synthetase fcl 0.0024
487 Aldo-keto reductase family 1 member C4 AKR1C4 0.0024
149 Alpha-aminoadipic semialdehyde dehydrogenase ALDH7A1 0.0024
167 L-lactate dehydrogenase C chain LDHC 0.0024
326 L-lactate dehydrogenase A-like 6A LDHAL6A 0.0024
206 3-keto-steroid reductase HSD17B7 0.0024
721 NADH-ubiquinone oxidoreductase chain 2 MT-ND2 0.0024
50 Sterol-4-alpha-carboxylate 3-dehydrogenase, decarboxylating NSDHL 0.0024
335 NADH dehydrogenase [ubiquinone] 1 alpha subcomplex subunit 9, mitochondrial NDUFA9 0.0024
216 Aldehyde dehydrogenase 3B2 ALDH3B2 0.0024
616 Isocitrate dehydrogenase [NAD] subunit beta, mitochondrial IDH3B 0.0024
9 Estradiol 17-beta-dehydrogenase 2 HSD17B2 0.0024
671 Pyruvate dehydrogenase E1 component alpha subunit, testis-specific form, mitochondrial PDHA2 0.0024
628 Pyruvate dehydrogenase E1 component alpha subunit, somatic form, mitochondrial PDHA1 0.0024
848 Isocitrate dehydrogenase [NAD] subunit gamma, mitochondrial IDH3G 0.0024
145 Corticosteroid 11-beta-dehydrogenase isozyme 2 HSD11B2 0.0024
608 NADH-ubiquinone oxidoreductase chain 4 MT-ND4 0.0024
539 NADH dehydrogenase [ubiquinone] flavoprotein 1, mitochondrial NDUFV1 0.0024
548 NADH-ubiquinone oxidoreductase 75 kDa subunit, mitochondrial NDUFS1 0.0024
496 Aldehyde dehydrogenase 3B1 ALDH3B1 0.0024
34 7-dehydrocholesterol reductase DHCR7 0.0024
662 Fatty aldehyde dehydrogenase ALDH3A2 0.0024
288 Trifunctional enzyme subunit alpha, mitochondrial HADHA 0.0024
711 UDP-glucose 6-dehydrogenase UGDH 0.0024
3672 UDP-glucose 6-dehydrogenase hasB 0.0024
531 Aldehyde dehydrogenase X, mitochondrial ALDH1B1 0.0024
180 D-3-phosphoglycerate dehydrogenase PHGDH 0.0024
3726 D-3-phosphoglycerate dehydrogenase serA 0.0024
4291 D-3-phosphoglycerate dehydrogenase serA 0.0024
258 Methylmalonate-semialdehyde dehydrogenase [acylating], mitochondrial ALDH6A1 0.0024
271 Delta-1-pyrroline-5-carboxylate dehydrogenase, mitochondrial ALDH4A1 0.0024
637 NADH-ubiquinone oxidoreductase chain 5 MT-ND5 0.0024
643 Peroxisomal bifunctional enzyme EHHADH 0.0024
393 GDH/6PGL endoplasmic bifunctional protein [Includes: Glucose 1-dehydrogenase H6PD 0.0024
350 3-hydroxyacyl-CoA dehydrogenase type-2 HSD17B10 0.0022
178 NADH-cytochrome b5 reductase 3 CYB5R3 0.0022
812 Dihydrolipoyl dehydrogenase, mitochondrial DLD 0.0022
454 Peroxisomal multifunctional enzyme type 2 HSD17B4 0.0022
328 Sorbitol dehydrogenase SORD 0.0022
363 NADP-dependent malic enzyme, mitochondrial ME3 0.0022
396 Alcohol dehydrogenase 4 ADH4 0.0022
597 Dihydropteridine reductase QDPR 0.0022
857 Malate dehydrogenase, mitochondrial MDH2 0.0022
839 Short-chain specific acyl-CoA dehydrogenase, mitochondrial ACADS 0.0021
419 Hydroxyacyl-coenzyme A dehydrogenase, mitochondrial HADH 0.0021
12 Alcohol dehydrogenase class 3 ADH5 0.0021
74 Dihydrolipoyllysine-residue acetyltransferase component of pyruvate dehydrogenase complex, mitochondrial DLAT 0.0021
77 L-lactate dehydrogenase B chain LDHB 0.0021
830 Glutamate dehydrogenase 2, mitochondrial GLUD2 0.002
599 Glyceraldehyde-3-phosphate dehydrogenase GAPDH 0.002
4426 Glyceraldehyde-3-phosphate dehydrogenase gap 0.002
4454 Glyceraldehyde-3-phosphate dehydrogenase gap 0.002
4489 Glyceraldehyde-3-phosphate dehydrogenase gap 0.002
473 L-lactate dehydrogenase A chain LDHA 0.002
794 Glyceraldehyde-3-phosphate dehydrogenase, testis-specific GAPDHS 0.002
6026 Alcohol dehydrogenase 6 ADH6 0.002
83 Alpha-aminoadipic semialdehyde synthase, mitochondrial AASS 0.0019
166 NAD-dependent malic enzyme, mitochondrial ME2 0.0019
626 Cysteine dioxygenase type 1 CDO1 0.0019
248 Pyrroline-5-carboxylate reductase 1 PYCR1 0.0019
802 Pyrroline-5-carboxylate reductase 2 PYCR2 0.0019
182 2-oxoglutarate dehydrogenase E1 component, mitochondrial OGDH 0.0019
337 NADH dehydrogenase [ubiquinone] iron-sulfur protein 7, mitochondrial NDUFS7 0.0019
214 NADH dehydrogenase [ubiquinone] iron-sulfur protein 3, mitochondrial NDUFS3 0.0019
803 NADH dehydrogenase [ubiquinone] iron-sulfur protein 2, mitochondrial NDUFS2 0.0019
194 NADH dehydrogenase [ubiquinone] 1 subunit C2 NDUFC2 0.0019
110 Pyruvate dehydrogenase E1 component subunit beta, mitochondrial PDHB 0.0019
627 11-cis retinol dehydrogenase RDH5 0.0018
640 Aldehyde dehydrogenase 1A3 ALDH1A3 0.0018
201 Glutamate dehydrogenase 1, mitochondrial GLUD1 0.0018
66 3 beta-hydroxysteroid dehydrogenase/Delta 5-->4-isomerase type II HSD3B2 0.0018
569 Retinal dehydrogenase 2 ALDH1A2 0.0018
611 Retinal dehydrogenase 1 ALDH1A1 0.0017
251 Alcohol dehydrogenase 1A ADH1A 0.0017
796 Inosine-5'-monophosphate dehydrogenase 2 IMPDH2 0.0017
57 3 beta-hydroxysteroid dehydrogenase/Delta 5-->4-isomerase type I HSD3B1 0.0017
810 Heme oxygenase 1 HMOX1 0.0017
3391 Heme oxygenase 1 pbsA1 0.0017
838 Inosine-5'-monophosphate dehydrogenase 1 IMPDH1 0.0016
279 Tyrosinase TYR 0.0016
170 Succinate semialdehyde dehydrogenase, mitochondrial ALDH5A1 0.0016
714 Glutathione reductase, mitochondrial GSR 0.0015
380 Cytochrome P450 17A1 CYP17A1 0.0015
243 Ribosyldihydronicotinamide dehydrogenase [quinone] NQO2 0.0015
147 Aldehyde dehydrogenase, mitochondrial ALDH2 0.0015
517 Alcohol dehydrogenase 1C ADH1C 0.0014
559 NADH-ubiquinone oxidoreductase chain 1 MT-ND1 0.0013
468 Cytochrome P450 4A11 CYP4A11 0.0013
6020 Aldehyde oxidase AOX1 0.0013
3947 Xanthine dehydrogenase/oxidase XDH 0.0012
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