QuartataWeb 1.0

18 known interactions (drugs) of input target (ADH1C): Alcohol dehydrogenase 1C

No.	Group	Type	Drug ID	Drug Name	SMILES ⇨ TargetHunter
1	Approved; Vet approved	SmallMoleculeDrug	DB01213	Fomepizole	CC1=CNN=C1
2	Experimental	SmallMoleculeDrug	DB02871	3-Butylthiolane 1-Oxide	[H][C@]1(CCCC)CC[S@](=O)C1
3	Experimental	SmallMoleculeDrug	DB03559	Cyclohexylformamide	O=CNC1CCCCC1
4	Experimental	SmallMoleculeDrug	DB02757	Pyrazole	N1C=CC=N1
5	Experimental	SmallMoleculeDrug	DB04113	N-Formylpiperidine	O=CN1CCCCC1
6	Experimental	SmallMoleculeDrug	DB02721	4-Iodopyrazole	IC1=CNN=C1
7	Experimental	SmallMoleculeDrug	DB01711	2,3,4,5,6-Pentafluorobenzyl Alcohol	OCC1=C(F)C(F)=C(F)C(F)=C1F
8	Experimental	SmallMoleculeDrug	DB02822	Para-Bromobenzyl Alcohol	OCC1=CC=C(Br)C=C1
9	Experimental	SmallMoleculeDrug	DB04071	Cpad	NC(=O)C1=NC(=CC=C1)[C@@H]1O[C@H](COP(O)(=O)OP(O)(=O)OC[C@H]2O[C@H]([C@H](O)[C@@H]2O)N2C=NC3=C2N=CN=C3N)[C@@H](O)[C@H]1O
10	Experimental	SmallMoleculeDrug	DB03226	Trifluoroethanol	OCC(F)(F)F
11	Approved	SmallMoleculeDrug	DB02659	Cholic Acid	[H][C@@](C)(CCC(O)=O)[C@@]1([H])CC[C@@]2([H])[C@]3([H])[C@]([H])(O)C[C@]4([H])C[C@]([H])(O)CC[C@]4(C)[C@@]3([H])C[C@]([H])(O)[C@]12C
12	Approved; Nutraceutical	SmallMoleculeDrug	DB00157	NADH	NC(=O)C1=CN(C=CC1)[C@@H]1O[C@H](CO[P@](O)(=O)O[P@](O)(=O)OC[C@H]2O[C@H]([C@H](O)[C@@H]2O)N2C=NC3=C(N)N=CN=C23)[C@@H](O)[C@H]1O
13	Experimental	SmallMoleculeDrug	DB02131	N-1-Methylheptylformamide	[H][C@@](C)(CCCCCC)N=CO
14	Experimental	SmallMoleculeDrug	DB03020	5-Beta-D-Ribofuranosylnicotinamide Adenine Dinucleotide	[H][C@]1(COP(O)(=O)OP(O)(=O)OC[C@@]2([H])O[C@@]([H])(C3=CC(=CN=C3)C(O)=N)[C@]([H])(O)[C@]2([H])O)O[C@@]([H])(N2C=NC3=C(N)N=CN=C23)[C@]([H])(O)[C@]1([H])O
15	Experimental	SmallMoleculeDrug	DB03061	(R)-N-(1-Methyl-Hexyl)-Formamide	CCCCC[C@H](C)NC=O
16	Experimental	SmallMoleculeDrug	DB04448	2,4-Difluorobenzyl Alcohol 2,4-Difluoro-1-(Hydroxymethyl)Benzene	OCC1=CC=C(F)C=C1F
17	Experimental	SmallMoleculeDrug	DB02249	2-Ethoxyethanol	CCOCCO
18	Experimental	SmallMoleculeDrug	DB04312	2,3-Difluorobenzyl Alcohol	OCC1=CC=CC(F)=C1F

20 predicted interactions (drugs) of input target (ADH1C): Alcohol dehydrogenase 1C

No.	Group	Type	Drug ID	Drug Name	SMILES ⇨ TargetHunter	Confidence score
1	Experimental	SmallMoleculeDrug	DB04464	N-Formylmethionine	[H][C@@](CCSC)(NC=O)C(O)=O	39.7%
2	Approved	SmallMoleculeDrug	DB03147	Flavin adenine dinucleotide	CC1=CC2=C(C=C1C)N(C[C@H](O)[C@H](O)[C@H](O)CO[P@](O)(=O)O[P@@](O)(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)N1C=NC3=C1N=CN=C3N)C1=NC(=O)NC(=O)C1=N2	32.8%
3	Approved	BiotechDrug	DB00098	Antithymocyte immunoglobulin (rabbit)	NA	31.3%
4	Approved; Investigational	SmallMoleculeDrug	DB12010	Fostamatinib	COC1=CC(NC2=NC=C(F)C(NC3=NC4=C(OC(C)(C)C(=O)N4COP(O)(O)=O)C=C3)=N2)=CC(OC)=C1OC	28.1%
5	Experimental	SmallMoleculeDrug	DB08231	Myristic acid	CCCCCCCCCCCCCC(O)=O	27.5%
6	Approved; Nutraceutical	SmallMoleculeDrug	DB00172	L-Proline	OC(=O)[C@@H]1CCCN1	27.4%
7	Approved; Investigational	SmallMoleculeDrug	DB00313	Valproic Acid	CCCC(CCC)C(O)=O	26.8%
8	Approved	SmallMoleculeDrug	DB06777	Chenodeoxycholic acid	[H][C@@]1(CC[C@@]2([H])[C@]3([H])[C@H](O)C[C@]4([H])C[C@H](O)CC[C@]4(C)[C@@]3([H])CC[C@]12C)[C@H](C)CCC(O)=O	26.4%
9	Approved	BiotechDrug	DB00031	Tenecteplase	NA	25.2%
10	Experimental	SmallMoleculeDrug	DB04137	Guanosine-5'-Triphosphate	NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)[C@@H](O)[C@H]2O)C(=O)N1	24.7%
11	Approved; Investigational	SmallMoleculeDrug	DB11967	Binimetinib	CN1C=NC2=C(F)C(NC3=CC=C(Br)C=C3F)=C(C=C12)C(=O)NOCCO	23.9%
12	Approved; Investigational	SmallMoleculeDrug	DB01593	Zinc	[Zn]	23.1%
13	Approved; Investigational	SmallMoleculeDrug	DB08889	Carfilzomib	CC(C)C[C@H](NC(=O)[C@H](CCC1=CC=CC=C1)NC(=O)CN1CCOCC1)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CC(C)C)C(=O)[C@@]1(C)CO1	22.9%
14	Approved; Investigational	SmallMoleculeDrug	DB03615	Ribostamycin	[H][C@]1(CO)O[C@@]([H])(O[C@]2([H])[C@@]([H])(O)[C@]([H])(N)C[C@]([H])(N)[C@@]2([H])O[C@@]2([H])O[C@]([H])(CN)[C@@]([H])(O)[C@]([H])(O)[C@@]2([H])N)[C@]([H])(O)[C@]1([H])O	22.6%
15	Approved; Investigational	SmallMoleculeDrug	DB09130	Copper	[Cu]	22.2%
16	Approved; Nutraceutical	SmallMoleculeDrug	DB00125	L-Arginine	N[C@@H](CCCNC(N)=N)C(O)=O	22.2%
17	Experimental	SmallMoleculeDrug	DB04604	5-iodotubercidin	[H][C@]1(CO)O[C@@]([H])(N2C=C(I)C3=C(N)N=CN=C23)[C@]([H])(O)[C@]1([H])O	22.2%
18	Approved; Investigational	SmallMoleculeDrug	DB08901	Ponatinib	CN1CCN(CC2=CC=C(NC(=O)C3=CC(C#CC4=CN=C5C=CC=NN45)=C(C)C=C3)C=C2C(F)(F)F)CC1	22.0%
19	Investigational	SmallMoleculeDrug	DB01645	Genistein	OC1=CC=C(C=C1)C1=COC2=C(C(O)=CC(O)=C2)C1=O	22.0%
20	Experimental	SmallMoleculeDrug	DB02059	Adenosine-5-Diphosphoribose	NC1=C2N=CN([C@@H]3O[C@H](CO[P@@](O)(=O)O[P@@](O)(=O)OC[C@H]4O[C@H](O)[C@H](O)[C@@H]4O)[C@@H](O)[C@H]3O)C2=NC=N1	21.8%