QuartataWeb 1.0

Data source: DrugBank-all; Query type: target; # of requested predictions: 20; Secondary interactions: no
Input target 1: Q9Y600

No. Gene UniProt ID Protein Name Pathway PDB

1 CSAD Q9Y600 Cysteine sulfinic acid decarboxylase hsa00430; hsa01100 2JIS

2 known interactions (drugs) of input target (CSAD): Cysteine sulfinic acid decarboxylase

No.	Group	Type	Drug ID	Drug Name	SMILES ⇨ TargetHunter	Image
1	Approved; Investigational; Nutraceutical	SmallMoleculeDrug	DB00114	Pyridoxal Phosphate	CC1=NC=C(COP(O)(O)=O)C(C=O)=C1O
2	Approved; Nutraceutical	SmallMoleculeDrug	DB00151	L-Cysteine	N[C@@H](CS)C(O)=O

20 predicted interactions (drugs) of input target (CSAD): Cysteine sulfinic acid decarboxylase

No.	Group	Type	Drug ID	Drug Name	SMILES ⇨ TargetHunter	Confidence score
1	Approved; Nutraceutical; Vet approved	SmallMoleculeDrug	DB00145	Glycine	NCC(O)=O	38.6%
2	Approved; Nutraceutical	SmallMoleculeDrug	DB00142	Glutamic Acid	N[C@@H](CCC(O)=O)C(O)=O	28.2%
3	Approved; Nutraceutical	SmallMoleculeDrug	DB00160	L-Alanine	C[C@H](N)C(O)=O	24.7%
4	Approved; Nutraceutical	SmallMoleculeDrug	DB00133	Serine	N[C@@H](CO)C(O)=O	21.1%
5	Approved; Investigational	SmallMoleculeDrug	DB09130	Copper	[Cu]	19.9%
6	Approved; Investigational; Nutraceutical	SmallMoleculeDrug	DB00118	Ademetionine	[H][C@](N)(CC[S+](C)C[C@@]1([H])O[C@@]([H])(N2C=NC3=C(N)N=CN=C23)[C@]([H])(O)[C@]1([H])O)C([O-])=O	19.0%
7	Experimental	SmallMoleculeDrug	DB04299	Maleic Acid	OC(=O)\C=C/C(O)=O	18.6%
8	Approved; Investigational	SmallMoleculeDrug	DB11638	Artenimol	[H][C@@]1(C)CC[C@@]2([H])[C@@]([H])(C)C([H])(O)O[C@]3([H])O[C@@]4(C)CC[C@]1([H])[C@@]23OO4	18.2%
9	Nutraceutical	SmallMoleculeDrug	DB00116	Tetrahydrofolic acid	NC1=NC(=O)C2=C(NCC(CNC3=CC=C(C=C3)C(=O)N[C@@H](CCC(O)=O)C(O)=O)N2)N1	17.4%
10	Experimental	SmallMoleculeDrug	DB03928	Carboxymethylthio-3-(3-Chlorophenyl)-1,2,4-Oxadiazol	OC(=O)CSC1=NC(=NO1)C1=CC=CC(Cl)=C1	15.9%
11	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	14.1%
12	Approved	SmallMoleculeDrug	DB00780	Phenelzine	NNCCC1=CC=CC=C1	13.8%
13	Experimental	SmallMoleculeDrug	DB03408	gamma-Glutamylcysteine	N[C@@H](CCC(=O)N[C@@H](CS)C(O)=O)C(O)=O	13.6%
14	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	13.2%
15	Approved; Nutraceutical	SmallMoleculeDrug	DB00170	Menadione	CC1=CC(=O)C2=CC=CC=C2C1=O	12.9%
16	Experimental	SmallMoleculeDrug	DB03461	2'-Monophosphoadenosine 5'-Diphosphoribose	[H][C@]1(COP([O-])(=O)OP(O)(=O)OC[C@@]2([H])O[C@@]([H])([N+]3=CC=CC(=C3)C(O)=N)[C@]([H])(O)[C@]2([H])O)O[C@@]([H])(N2C=NC3=C(N)N=CN=C23)[C@]([H])(OP(O)(O)=O)[C@]1([H])O	12.4%
17	Approved; Nutraceutical	SmallMoleculeDrug	DB00128	L-Aspartic Acid	N[C@@H](CC(O)=O)C(O)=O	12.2%
18	Experimental	SmallMoleculeDrug	DB03401	1D-myo-inositol 1,4,5-trisphosphate	O[C@@H]1[C@H](O)[C@@H](OP(O)(O)=O)[C@H](OP(O)(O)=O)[C@@H](O)[C@@H]1OP(O)(O)=O	11.9%
19	Approved; Investigational	SmallMoleculeDrug	DB06151	Acetylcysteine	CC(=O)N[C@@H](CS)C(O)=O	11.6%
20	Approved; Investigational	SmallMoleculeDrug	DB00996	Gabapentin	NCC1(CC(O)=O)CCCCC1	11.0%