BDBM50224724 CHEMBL238066::tert-butyl 4-((5-chloro-2-(1-(2-(3-oxo-2,3-dihydrobenzo[b][1,4]oxazin-4-yl)ethyl)piperidin-4-yl)benzamido)methyl)piperidine-1-carboxylate

SMILES: CC(C)(C)OC(=O)N1CCC(CNC(=O)c2cc(Cl)ccc2C2CCN(CCN3C(=O)COc4ccccc34)CC2)CC1

InChI Key: InChIKey=AZZYTBNDKWLIQD-UHFFFAOYSA-N

Data: 1 KI  1 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 = 50224724   

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
Urotensin II receptor (Homo sapiens (Human))	BDBM50224724 (CHEMBL238066 | tert-butyl 4-((5-chloro-2-(1-(2-(3-...) Show SMILES CC(C)(C)OC(=O)N1CCC(CNC(=O)c2cc(Cl)ccc2C2CCN(CCN3C(=O)COc4ccccc34)CC2)CC1 Show InChI InChI=1S/C33H43ClN4O5/c1-33(2,3)43-32(41)37-16-10-23(11-17-37)21-35-31(40)27-20-25(34)8-9-26(27)24-12-14-36(15-13-24)18-19-38-28-6-4-5-7-29(28)42-22-30(38)39/h4-9,20,23-24H,10-19,21-22H2,1-3H3,(H,35,40)	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	140	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Johnson & Johnson Pharmaceutical Research & Development Curated by ChEMBL					Assay Description Displacement of [125I]U2 from human UT receptor in RMS13 cells after 2.5 hrs				Bioorg Med Chem Lett 17: 6489-92 (2007) Article DOI: 10.1016/j.bmcl.2007.09.092 BindingDB Entry DOI: 10.7270/Q2C53KKJ
					More data for this Ligand-Target Pair
UTS2R (RAT)	BDBM50224724 (CHEMBL238066 | tert-butyl 4-((5-chloro-2-(1-(2-(3-...) Show SMILES CC(C)(C)OC(=O)N1CCC(CNC(=O)c2cc(Cl)ccc2C2CCN(CCN3C(=O)COc4ccccc34)CC2)CC1 Show InChI InChI=1S/C33H43ClN4O5/c1-33(2,3)43-32(41)37-16-10-23(11-17-37)21-35-31(40)27-20-25(34)8-9-26(27)24-12-14-36(15-13-24)18-19-38-28-6-4-5-7-29(28)42-22-30(38)39/h4-9,20,23-24H,10-19,21-22H2,1-3H3,(H,35,40)	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	600	n/a	n/a	n/a	n/a	n/a	n/a
Johnson & Johnson Pharmaceutical Research & Development Curated by ChEMBL					Assay Description Antagonist activity at rat UT receptor transfected in CHOK1 cells assessed as calcium mobilization by FLIPR method				Bioorg Med Chem Lett 17: 6489-92 (2007) Article DOI: 10.1016/j.bmcl.2007.09.092 BindingDB Entry DOI: 10.7270/Q2C53KKJ
					More data for this Ligand-Target Pair