BDBM50019426 CHEMBL3290089

SMILES: COc1cccc(OC)c1-c1cc(nn1-c1ccnc2cc(Cl)ccc12)C(=O)NC1C2CC3CC(C2)CC1C3

InChI Key: InChIKey=LWSJPDMZBABZMO-UHFFFAOYSA-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 = 50019426   

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
Neurotensin receptor 2 (Rattus norvegicus)	BDBM50019426 (CHEMBL3290089) Show SMILES COc1cccc(OC)c1-c1cc(nn1-c1ccnc2cc(Cl)ccc12)C(=O)NC1C2CC3CC(C2)CC1C3 |TLB:38:37:35:31.32.33,THB:28:29:35:31.32.33,38:32:29.37.36:35,33:32:29:36.34.35,33:34:29:31.38.32,(32.46,-36.27,;32.94,-34.8,;34.44,-34.48,;35.47,-35.63,;36.98,-35.3,;37.45,-33.84,;36.42,-32.7,;36.9,-31.23,;38.4,-30.91,;34.92,-33.02,;33.58,-31.53,;33.9,-30.02,;32.57,-29.25,;31.42,-30.28,;32.05,-31.69,;31.04,-33.42,;31.81,-34.76,;31.04,-36.09,;29.51,-36.09,;28.74,-34.76,;27.19,-34.76,;26.43,-33.42,;24.89,-33.42,;27.19,-32.09,;28.74,-32.09,;29.51,-33.42,;32.41,-27.72,;33.65,-26.82,;31,-27.09,;30.84,-25.56,;30.47,-23.79,;31.67,-22.96,;32.22,-21.58,;30.93,-20.66,;29.62,-21.49,;29.21,-22.91,;30.03,-23.1,;31.38,-24.05,;32.69,-23.2,)| Show InChI InChI=1S/C31H31ClN4O3/c1-38-27-4-3-5-28(39-2)29(27)26-16-24(31(37)34-30-19-11-17-10-18(13-19)14-20(30)12-17)35-36(26)25-8-9-33-23-15-21(32)6-7-22(23)25/h3-9,15-20,30H,10-14H2,1-2H3,(H,34,37)	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	62	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Research Triangle Institute Curated by ChEMBL					Assay Description Displacement of [125I]NT at rat NTS2 overexpressed in CHOK1 cells after 30 mins by gamma counting				J Med Chem 57: 5318-32 (2014) Article DOI: 10.1021/jm5003843 BindingDB Entry DOI: 10.7270/Q2PR7XJD
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