BDBM50290053 CHEMBL70339::Pyridin-2-yl-carbamic acid 2-[6-(4-tert-butyl-benzenesulfonylamino)-5-(2-methoxy-phenoxy)-2-morpholin-4-yl-pyrimidin-4-yloxy]-ethyl ester

SMILES: COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(cc2)C(C)(C)C)nc(nc1OCCOC(=O)Nc1ccccn1)N1CCOCC1

InChI Key: InChIKey=HOULTIREPNOFQE-UHFFFAOYSA-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 = 50290053   

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
EDNRB (Homo sapiens (Human))	BDBM50290053 (CHEMBL70339 | Pyridin-2-yl-carbamic acid 2-[6-(4-t...) Show SMILES COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(cc2)C(C)(C)C)nc(nc1OCCOC(=O)Nc1ccccn1)N1CCOCC1 Show InChI InChI=1S/C33H38N6O8S/c1-33(2,3)23-12-14-24(15-13-23)48(41,42)38-29-28(47-26-10-6-5-9-25(26)43-4)30(37-31(36-29)39-17-19-44-20-18-39)45-21-22-46-32(40)35-27-11-7-8-16-34-27/h5-16H,17-22H2,1-4H3,(H,34,35,40)(H,36,37,38)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	19	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Receptor binding affinity was determined against [125I]ET1 with membranes prepared from human placenta for ETB receptor				Bioorg Med Chem Lett 7: 2223-2228 (1997) Article DOI: 10.1016/S0960-894X(97)00400-9 BindingDB Entry DOI: 10.7270/Q2WQ049M
					More data for this Ligand-Target Pair
Endothelin-1 receptor (Homo sapiens (Human))	BDBM50290053 (CHEMBL70339 | Pyridin-2-yl-carbamic acid 2-[6-(4-t...) Show SMILES COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(cc2)C(C)(C)C)nc(nc1OCCOC(=O)Nc1ccccn1)N1CCOCC1 Show InChI InChI=1S/C33H38N6O8S/c1-33(2,3)23-12-14-24(15-13-23)48(41,42)38-29-28(47-26-10-6-5-9-25(26)43-4)30(37-31(36-29)39-17-19-44-20-18-39)45-21-22-46-32(40)35-27-11-7-8-16-34-27/h5-16H,17-22H2,1-4H3,(H,34,35,40)(H,36,37,38)	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	17	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Receptor binding affinity was determined against [125I]ET1 with recombinant human ETA receptor, expressed in baculovirus-infected Sf9 cells				Bioorg Med Chem Lett 7: 2223-2228 (1997) Article DOI: 10.1016/S0960-894X(97)00400-9 BindingDB Entry DOI: 10.7270/Q2WQ049M
					More data for this Ligand-Target Pair