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BDBM50198415 1-(3,5-bis(trifluoromethyl)phenyl)-3-(1-(cyclooctenylmethyl)piperidin-4-yl)urea::CHEMBL396793

SMILES: FC(F)(F)c1cc(NC(=O)NC2CCN(C\C3=C\CCCCCC3)CC2)cc(c1)C(F)(F)F

InChI Key: InChIKey=MFLVFGPYDWXLES-OMCISZLKSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50198415   
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
chemokine (C-X-C motif) receptor 3


(Homo sapiens (Human))
BDBM50198415
PNG
(1-(3,5-bis(trifluoromethyl)phenyl)-3-(1-(cycloocte...)
Show SMILES FC(F)(F)c1cc(NC(=O)NC2CCN(C\C3=C\CCCCCC3)CC2)cc(c1)C(F)(F)F |t:16|
Show InChI InChI=1S/C23H29F6N3O/c24-22(25,26)17-12-18(23(27,28)29)14-20(13-17)31-21(33)30-19-8-10-32(11-9-19)15-16-6-4-2-1-3-5-7-16/h6,12-14,19H,1-5,7-11,15H2,(H2,30,31,33)/b16-6+
UniProtKB/SwissProt

antibodypedia
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CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
36n/an/an/an/an/an/an/an/a



UCB

Curated by ChEMBL


Assay Description
Antagonist activity at human CXCR3 expressed in CHO cells by [35S]GTPgammaS binding assay


Bioorg Med Chem Lett 17: 697-701 (2007)


Article DOI: 10.1016/j.bmcl.2006.10.088
BindingDB Entry DOI: 10.7270/Q2833RPB
More data for this
Ligand-Target Pair