BDBM50225713 1-(1-(((1R,5S)-6,6-dimethylbicyclo[3.1.1]hept-2-en-2-yl)methyl)piperidin-4-yl)-1-ethyl-3-(3-(trifluoromethyl)phenyl)urea::CHEMBL249410

SMILES: CCN(C1CCN(CC2=CC[C@H]3C[C@@H]2C3(C)C)CC1)C(=O)Nc1cccc(c1)C(F)(F)F

InChI Key: InChIKey=WVRMNWWVKDVTLX-AVRDEDQJSA-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 = 50225713   

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))	BDBM50225713 (1-(1-(((1R,5S)-6,6-dimethylbicyclo[3.1.1]hept-2-en...) Show SMILES CCN(C1CCN(CC2=CC[C@H]3C[C@@H]2C3(C)C)CC1)C(=O)Nc1cccc(c1)C(F)(F)F |t:8| Show InChI InChI=1S/C25H34F3N3O/c1-4-31(23(32)29-20-7-5-6-19(14-20)25(26,27)28)21-10-12-30(13-11-21)16-17-8-9-18-15-22(17)24(18,2)3/h5-8,14,18,21-22H,4,9-13,15-16H2,1-3H3,(H,29,32)/t18-,22-/m0/s1	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.60E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
UCB Inflammation Discovery Curated by ChEMBL					Assay Description Binding affinity to human CXCR3 receptor expressed in CHO membrane by ITAC-stimulated GTP gammaS assay				Bioorg Med Chem Lett 17: 6806-10 (2007) Article DOI: 10.1016/j.bmcl.2007.10.029 BindingDB Entry DOI: 10.7270/Q24F1QGP
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