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Network of interactions between drugs (red spheres) and targets (blue spheres) is displayed above.
The red lines are used for the predicted interactions and the thickness of edges indicate the confidence score of predictions.

Data source: DrugBank-all; Query type: target; # of requested predictions: 20; Secondary interactions: no
Input target 1: P00915
No. Gene UniProt ID Protein Name Pathway PDB
1 CA1 P00915 Carbonic anhydrase 1 hsa00910

27 known interactions (drugs) of input target (CA1): Carbonic anhydrase 1
No. Group Type Drug ID Drug Name SMILES
⇨ TargetHunter
1 Approved SmallMoleculeDrug DB01194 Brinzolamide Thumb
2 Approved SmallMoleculeDrug DB00869 Dorzolamide Thumb
3 Approved SmallMoleculeDrug DB00562 Benzthiazide Thumb
4 Experimental SmallMoleculeDrug DB08155 N-{2-[4-(AMINOSULFONYL)PHENYL]ETHYL}ACETAMIDE Thumb
5 Approved;
Vet approved
SmallMoleculeDrug DB01021 Trichlormethiazide Thumb
6 Approved;
SmallMoleculeDrug DB01144 Diclofenamide Thumb
7 Approved SmallMoleculeDrug DB01119 Diazoxide Thumb
8 Approved SmallMoleculeDrug DB09460 Sodium carbonate Thumb
9 Approved;
SmallMoleculeDrug DB01031 Ethinamate Thumb
10 Withdrawn SmallMoleculeDrug DB00311 Ethoxzolamide Thumb
11 Approved SmallMoleculeDrug DB00436 Bendroflumethiazide Thumb
12 Experimental SmallMoleculeDrug DB08157 ETHYL 3-[4-(AMINOSULFONYL)PHENYL]PROPANOATE Thumb
13 Approved SmallMoleculeDrug DB00232 Methyclothiazide Thumb
14 Approved;
Vet approved
SmallMoleculeDrug DB00999 Hydrochlorothiazide Thumb
15 Approved;
Vet approved
SmallMoleculeDrug DB09472 Sodium sulfate Thumb
16 Approved SmallMoleculeDrug DB01325 Quinethazone Thumb
17 Approved SmallMoleculeDrug DB00606 Cyclothiazide Thumb
18 Approved;
Vet approved
SmallMoleculeDrug DB00819 Acetazolamide Thumb
19 Approved;
Vet approved
SmallMoleculeDrug DB00880 Chlorothiazide Thumb
20 Approved SmallMoleculeDrug DB00703 Methazolamide Thumb
21 Approved SmallMoleculeDrug DB00381 Amlodipine Thumb
22 Approved;
SmallMoleculeDrug DB00909 Zonisamide Thumb
23 Approved;
Vet approved
SmallMoleculeDrug DB00423 Methocarbamol Thumb
24 Experimental SmallMoleculeDrug DB08156 3-[4-(AMINOSULFONYL)PHENYL]PROPANOIC ACID Thumb
25 Approved;
SmallMoleculeDrug DB00774 Hydroflumethiazide Thumb
26 Investigational SmallMoleculeDrug DB08846 Ellagic Acid Thumb
27 Approved SmallMoleculeDrug DB00273 Topiramate Thumb

20 predicted interactions (drugs) of input target (CA1): Carbonic anhydrase 1
No. Group Type Drug ID Drug Name SMILES
⇨ TargetHunter
Image Confidence score
1 Approved;
SmallMoleculeDrug DB00391 Sulpiride Thumb 50.7%
2 Approved;
SmallMoleculeDrug DB00580 Valdecoxib Thumb 50.3%
3 Approved;
SmallMoleculeDrug DB00482 Celecoxib Thumb 49.9%
4 Experimental SmallMoleculeDrug DB03385 4-Methylimidazole Thumb 47.4%
5 Experimental SmallMoleculeDrug DB04203 3-Mercuri-4-Aminobenzenesulfonamide Thumb 43.0%
6 Approved;
SmallMoleculeDrug DB03904 Urea Thumb 42.3%
7 Experimental SmallMoleculeDrug DB07742 N-(2,3-DIFLUORO-BENZYL)-4-SULFAMOYL-BENZAMIDE Thumb 41.0%
8 Approved;
Vet approved
SmallMoleculeDrug DB00695 Furosemide Thumb 40.8%
9 Experimental SmallMoleculeDrug DB04002 4-Sulfonamide-[4-(Thiomethylaminobutane)]Benzamide Thumb 40.7%
10 Experimental SmallMoleculeDrug DB02429 4-(Aminosulfonyl)-N-[(4-Fluorophenyl)Methyl]-Benzamide Thumb 39.9%
11 Experimental SmallMoleculeDrug DB04549 4-(Aminosulfonyl)-N-[(2,3,4-Trifluorophenyl)Methyl]-Benzamide Thumb 39.5%
12 Experimental SmallMoleculeDrug DB08765 6-HYDROXY-1,3-BENZOTHIAZOLE-2-SULFONAMIDE Thumb 39.3%
13 Experimental SmallMoleculeDrug DB08046 2-chloro-5-[(1S)-1-hydroxy-3-oxo-2H-isoindol-1-yl]benzenesulfonamide Thumb 38.3%
14 Experimental SmallMoleculeDrug DB06954 2-(cycloheptylmethyl)-1,1-dioxido-1-benzothiophen-6-yl sulfamate Thumb 38.3%
15 Experimental SmallMoleculeDrug DB03596 N-[2-(1h-Indol-5-Yl)-Butyl]-4-Sulfamoyl-Benzamide Thumb 38.3%
16 Approved;
SmallMoleculeDrug DB01942 Formic Acid Thumb 38.3%
17 Experimental SmallMoleculeDrug DB04601 4-[(4-O-SULFAMOYLBENZYL)(4-CYANOPHENYL)AMINO]-4H-[1,2,4]-TRIAZOLE Thumb 38.2%
18 Approved SmallMoleculeDrug DB00524 Metolazone Thumb 37.8%
19 Experimental SmallMoleculeDrug DB02479 (R)-N-(3-Indol-1-Yl-2-Methyl-Propyl)-4-Sulfamoyl-Benzamide Thumb 37.7%
20 Experimental SmallMoleculeDrug DB04371 AL6528 Thumb 37.6%


Reference:  Hongchun Li, Fen Pei, D. Lansing Taylor and Ivet Bahar. (2020) QuartataWeb: Integrated Chemical–Protein-Pathway Mapping for Polypharmacology and Chemogenomics. Bioinformatics 36(12), 3935–3937.


The QuartataWeb server is maintained by the Bahar Lab at the Department of Computational & Systems Biology at the University of Pittsburgh, School of Medicine, and sponsored by the NIH awards P41 GM103712 and P01 DK096990; and by the Li Lab at Research Center for Computer-Aided Drug Discovery at Shenzhen Institutes of Advanced Technology, CAS.

For questions and comments please contact Hongchun Li.