BDBM50198403 CHEMBL242267::methyl 3-(3-(1-(cyclooctenylmethyl)piperidin-4-yl)ureido)benzoate

SMILES: COC(=O)c1cccc(NC(=O)NC2CCN(C\C3=C\CCCCCC3)CC2)c1

InChI Key: InChIKey=RXRCNBDAXTXFBE-QGMBQPNBSA-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 = 50198403   

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))	BDBM50198403 (CHEMBL242267 | methyl 3-(3-(1-(cyclooctenylmethyl)...) Show SMILES COC(=O)c1cccc(NC(=O)NC2CCN(C\C3=C\CCCCCC3)CC2)c1 |t:18| Show InChI InChI=1S/C23H33N3O3/c1-29-22(27)19-10-7-11-21(16-19)25-23(28)24-20-12-14-26(15-13-20)17-18-8-5-3-2-4-6-9-18/h7-8,10-11,16,20H,2-6,9,12-15,17H2,1H3,(H2,24,25,28)/b18-8+	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	660	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