BDBM50321587 1-(4-butoxyphenyl)-3-(2-(2-isopropylphenyl)benzofuran-7-yl)urea::CHEMBL1170327

SMILES: CCCCOc1ccc(NC(=O)Nc2cccc3cc(oc23)-c2ccccc2C(C)C)cc1

InChI Key: InChIKey=XGHMZNGMKKURIG-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 = 50321587   

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
Purinergic receptor P2Y1 (Homo sapiens (Human))	BDBM50321587 (1-(4-butoxyphenyl)-3-(2-(2-isopropylphenyl)benzofu...) Show SMILES CCCCOc1ccc(NC(=O)Nc2cccc3cc(oc23)-c2ccccc2C(C)C)cc1 Show InChI InChI=1S/C28H30N2O3/c1-4-5-17-32-22-15-13-21(14-16-22)29-28(31)30-25-12-8-9-20-18-26(33-27(20)25)24-11-7-6-10-23(24)19(2)3/h6-16,18-19H,4-5,17H2,1-3H3,(H2,29,30,31)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	640	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Displacement of [33P]2-MeS-ADP from human P2Y1 receptor expressed in human U2OS cells by scintillation counting				Bioorg Med Chem Lett 20: 4104-7 (2010) Article DOI: 10.1016/j.bmcl.2010.05.072 BindingDB Entry DOI: 10.7270/Q2HX1DNF
					More data for this Ligand-Target Pair
Purinergic receptor P2Y1 (Homo sapiens (Human))	BDBM50321587 (1-(4-butoxyphenyl)-3-(2-(2-isopropylphenyl)benzofu...) Show SMILES CCCCOc1ccc(NC(=O)Nc2cccc3cc(oc23)-c2ccccc2C(C)C)cc1 Show InChI InChI=1S/C28H30N2O3/c1-4-5-17-32-22-15-13-21(14-16-22)29-28(31)30-25-12-8-9-20-18-26(33-27(20)25)24-11-7-6-10-23(24)19(2)3/h6-16,18-19H,4-5,17H2,1-3H3,(H2,29,30,31)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Antagonist activity at P2Y1 expressed in HEK293 cells by FLIPR assay				Bioorg Med Chem Lett 20: 4104-7 (2010) Article DOI: 10.1016/j.bmcl.2010.05.072 BindingDB Entry DOI: 10.7270/Q2HX1DNF
					More data for this Ligand-Target Pair