BindingDB logo
myBDB logout
Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Carbonic anhydrase 9' and Ligand = 'BDBM50248707'   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kJ/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Carbonic anhydrase 9


(Homo sapiens (Human))		BDBM50248707
PNG
(CHEMBL4075581)
Show SMILES COc1cccc(\C=C\C(=O)N[C@@H]2[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]2NC(=S)Nc2ccc(cc2)S(N)(=O)=O)c1 |r|
Show InChI InChI=1S/C23H28N4O8S2/c1-34-15-4-2-3-13(11-15)5-10-18(29)26-19-21(31)20(30)17(12-28)35-22(19)27-23(36)25-14-6-8-16(9-7-14)37(24,32)33/h2-11,17,19-22,28,30-31H,12H2,1H3,(H,26,29)(H2,24,32,33)(H2,25,27,36)/b10-5+/t17-,19-,20-,21-,22-/m1/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 95n/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human carbonic anhydrase 9 using 4-nitrophenylacetate as substrate pretreated for 15 mins prior to test by spectrophotometr...

Eur J Med Chem 132: 1-10 (2017)


Article DOI: 10.1016/j.ejmech.2017.03.023
BindingDB Entry DOI: 10.7270/Q2WS8WNX
More data for this
Ligand-Target Pair