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BDBM268403 4-(6-(2,6-Dichlorobenzoyl)imidazo[1,5-a]pyrimidin-8-yl)benzoic acid::US9550771, Example 2

SMILES: OC(=O)c1ccc(cc1)-c1nc(Sc2c(Cl)cccc2Cl)n2ccccc12

InChI Key: InChIKey=CZVOWGMSHURFEW-UHFFFAOYSA-N

Data: 1 EC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 268403   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Nuclear receptor ROR-gamma


(Homo sapiens (Human))
BDBM268403
PNG
(4-(6-(2,6-Dichlorobenzoyl)imidazo[1,5-a]pyrimidin-...)
Show SMILES OC(=O)c1ccc(cc1)-c1nc(Sc2c(Cl)cccc2Cl)n2ccccc12
Show InChI InChI=1S/C20H12Cl2N2O2S/c21-14-4-3-5-15(22)18(14)27-20-23-17(16-6-1-2-11-24(16)20)12-7-9-13(10-8-12)19(25)26/h1-11H,(H,25,26)
PDB

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a 262n/an/an/a25



Genentech Inc

US Patent


Assay Description
ssays were carried out in 16-μL reaction volumes in black 384 Plus F Proxiplates (Perkin-Elmer 6008269). All assay components except test ligand...


US Patent US9550771 (2017)


BindingDB Entry DOI: 10.7270/Q2417036
More data for this
Ligand-Target Pair