BDBM50198407 1-(1-(cyclooctenylmethyl)piperidin-4-yl)-3-(5-phenylthiophen-2-yl)urea::CHEMBL242268

SMILES: O=C(NC1CCN(C\C2=C\CCCCCC2)CC1)Nc1ccc(s1)-c1ccccc1

InChI Key: InChIKey=XYILJCFIFJAYMS-AWQFTUOYSA-N

Data: 1 KI

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50198407   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
chemokine (C-X-C motif) receptor 3 (Homo sapiens (Human))	BDBM50198407 (1-(1-(cyclooctenylmethyl)piperidin-4-yl)-3-(5-phen...) Show SMILES O=C(NC1CCN(C\C2=C\CCCCCC2)CC1)Nc1ccc(s1)-c1ccccc1 |t:8| Show InChI InChI=1S/C25H33N3OS/c29-25(27-24-14-13-23(30-24)21-11-7-4-8-12-21)26-22-15-17-28(18-16-22)19-20-9-5-2-1-3-6-10-20/h4,7-9,11-14,22H,1-3,5-6,10,15-19H2,(H2,26,27,29)/b20-9+	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	108	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/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