BDBM50187031 (S)-N-(3,5-bis(trifluoromethyl)benzyl)-2-(2-(dimethylamino)ethylamino)-2-(thiophen-3-yl)acetamide::CHEMBL379818

SMILES: CN(C)CCN[C@H](C(=O)NCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)c1ccsc1

InChI Key: InChIKey=MTTGKUZGRFVEOS-INIZCTEOSA-N

Data: 2 IC50

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 2 hits for monomerid = 50187031   

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
C-C chemokine receptor type 2 (Homo sapiens (Human))	BDBM50187031 ((S)-N-(3,5-bis(trifluoromethyl)benzyl)-2-(2-(dimet...) Show SMILES CN(C)CCN[C@H](C(=O)NCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)c1ccsc1 Show InChI InChI=1S/C19H21F6N3OS/c1-28(2)5-4-26-16(13-3-6-30-11-13)17(29)27-10-12-7-14(18(20,21)22)9-15(8-12)19(23,24)25/h3,6-9,11,16,26H,4-5,10H2,1-2H3,(H,27,29)/t16-/m0/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	424	n/a	n/a	n/a	n/a	n/a	n/a
National Institute of Pharmaceutical Education and Research (NIPER) Curated by ChEMBL					Assay Description Antagonist activity at human CCR2b receptor				Bioorg Med Chem Lett 18: 1323-30 (2008) Article DOI: 10.1016/j.bmcl.2008.01.023 BindingDB Entry DOI: 10.7270/Q2SN08Q1
					More data for this Ligand-Target Pair
C-C chemokine receptor type 2 (Homo sapiens (Human))	BDBM50187031 ((S)-N-(3,5-bis(trifluoromethyl)benzyl)-2-(2-(dimet...) Show SMILES CN(C)CCN[C@H](C(=O)NCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)c1ccsc1 Show InChI InChI=1S/C19H21F6N3OS/c1-28(2)5-4-26-16(13-3-6-30-11-13)17(29)27-10-12-7-14(18(20,21)22)9-15(8-12)19(23,24)25/h3,6-9,11,16,26H,4-5,10H2,1-2H3,(H,27,29)/t16-/m0/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	424	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Displacement of [125I]MCP1 from human CCR2 expressed in CHO cells				Bioorg Med Chem Lett 16: 3735-9 (2006) Article DOI: 10.1016/j.bmcl.2006.04.045 BindingDB Entry DOI: 10.7270/Q2N01645
					More data for this Ligand-Target Pair