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BDBM208556 US9266876, 23

SMILES: C[C@@H]1CN(CCN1C(=O)Cn1ccc2cccnc12)c1scnc1-c1nc2ccc(Cl)cc2[nH]1

InChI Key: InChIKey=PZQMHAPTLOZMNF-OAHLLOKOSA-N

Data: 1 IC50

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 = 208556   
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
CXCR3A / G protein (Galpha(16))


(Homo sapiens (Human))
BDBM208556
PNG
(US9266876, 23)
Show SMILES C[C@@H]1CN(CCN1C(=O)Cn1ccc2cccnc12)c1scnc1-c1nc2ccc(Cl)cc2[nH]1
Show InChI InChI=1S/C24H22ClN7OS/c1-15-12-31(9-10-32(15)20(33)13-30-8-6-16-3-2-7-26-23(16)30)24-21(27-14-34-24)22-28-18-5-4-17(25)11-19(18)29-22/h2-8,11,14-15H,9-10,12-13H2,1H3,(H,28,29)/t15-/m1/s1
UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 0.200n/an/an/an/a7.437



Actelion Pharmaceuticals Ltd.

US Patent


Assay Description
The bioactivity of compounds is tested in a fluorometric imaging plate reader (FLIPR: Molecular Devices) using engineered CHO-K1 cells expressing the...


US Patent US9266876 (2016)


BindingDB Entry DOI: 10.7270/Q2DB80NB
More data for this
Ligand-Target Pair