BDBM50302705 (S)-5-(4-(butoxycarbonyl)piperazin-1-yl)-4-(6-(4-(2-methoxyethyl)piperidin-1-yl)-2-phenylpyrimidine-4-carboxamido)-5-oxopentanoic acid::CHEMBL570256

SMILES: CCCCOC(=O)N1CCN(CC1)C(=O)[C@H](CCC(O)=O)NC(=O)c1cc(nc(n1)-c1ccccc1)N1CCC(CCOC)CC1

InChI Key: InChIKey=UALKMJQTNUBZKR-SANMLTNESA-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 = 50302705   

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 P2Y12 (Homo sapiens (Human))	BDBM50302705 ((S)-5-(4-(butoxycarbonyl)piperazin-1-yl)-4-(6-(4-(...) Show SMILES CCCCOC(=O)N1CCN(CC1)C(=O)[C@H](CCC(O)=O)NC(=O)c1cc(nc(n1)-c1ccccc1)N1CCC(CCOC)CC1 |r| Show InChI InChI=1S/C33H46N6O7/c1-3-4-21-46-33(44)39-19-17-38(18-20-39)32(43)26(10-11-29(40)41)35-31(42)27-23-28(36-30(34-27)25-8-6-5-7-9-25)37-15-12-24(13-16-37)14-22-45-2/h5-9,23-24,26H,3-4,10-22H2,1-2H3,(H,35,42)(H,40,41)/t26-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Global Research and Development Curated by ChEMBL					Assay Description Binding affinity at human recombinant P2Y12 receptor expressed in CHO cells by radioligand binding assay				Bioorg Med Chem Lett 19: 6148-56 (2009) Article DOI: 10.1016/j.bmcl.2009.09.017 BindingDB Entry DOI: 10.7270/Q2B27VCB
					More data for this Ligand-Target Pair
Purinergic receptor P2Y12 (Homo sapiens (Human))	BDBM50302705 ((S)-5-(4-(butoxycarbonyl)piperazin-1-yl)-4-(6-(4-(...) Show SMILES CCCCOC(=O)N1CCN(CC1)C(=O)[C@H](CCC(O)=O)NC(=O)c1cc(nc(n1)-c1ccccc1)N1CCC(CCOC)CC1 |r| Show InChI InChI=1S/C33H46N6O7/c1-3-4-21-46-33(44)39-19-17-38(18-20-39)32(43)26(10-11-29(40)41)35-31(42)27-23-28(36-30(34-27)25-8-6-5-7-9-25)37-15-12-24(13-16-37)14-22-45-2/h5-9,23-24,26H,3-4,10-22H2,1-2H3,(H,35,42)(H,40,41)/t26-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Global Research and Development Curated by ChEMBL					Assay Description Antagonist activity at P2Y12 receptor in human platelet rich plasma assessed as inhibition of ADP-induced platelet aggregation by light transmission ...				Bioorg Med Chem Lett 19: 6148-56 (2009) Article DOI: 10.1016/j.bmcl.2009.09.017 BindingDB Entry DOI: 10.7270/Q2B27VCB
					More data for this Ligand-Target Pair