new BindingDB logo
myBDB logout
Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Carbonic anhydrase 12' and Ligand = 'BDBM50118208'   
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 12


(Homo sapiens (Human))
BDBM50118208
PNG
(CHEMBL3613283)
Show SMILES CC(=O)O[C@@H]1[C@@H](COP2(=O)OCc3ccccc3O2)O[C@H]([C@H](OC(C)=O)[C@H]1OC(C)=O)n1cc(nn1)-c1ccc(cc1)S(N)(=O)=O |r|
Show InChI InChI=1/C27H29N4O13PS/c1-15(32)40-24-23(14-39-45(35)38-13-19-6-4-5-7-22(19)44-45)43-27(26(42-17(3)34)25(24)41-16(2)33)31-12-21(29-30-31)18-8-10-20(11-9-18)46(28,36)37/h4-12,23-27H,13-14H2,1-3H3,(H2,28,36,37)/t23-,24-,25+,26-,27-,45?/s2
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
51n/an/an/an/an/an/an/an/a



Griffith University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase-12 by stopped-flow CO2 hydration assay


J Med Chem 58: 7580-90 (2015)


BindingDB Entry DOI: 10.7270/Q2QC0591
More data for this
Ligand-Target Pair