null

SMILES: CCCCCOC(=O)N1CCN(CC1)C(=O)[C@H](CCC(O)=O)NC(=O)c1nc(OCCOC)cc(n1)-c1ccccc1

InChI Key: InChIKey=MBKRUNMEAGPEHL-QFIPXVFZSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50302676   

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
P2Y purinoceptor 12 (Homo sapiens (Human))	BDBM50302676 ((S)-4-(4-(2-methoxyethoxy)-6-phenylpyrimidine-2-ca...) Show SMILES CCCCCOC(=O)N1CCN(CC1)C(=O)[C@H](CCC(O)=O)NC(=O)c1nc(OCCOC)cc(n1)-c1ccccc1 |r| Show InChI InChI=1S/C29H39N5O8/c1-3-4-8-17-42-29(39)34-15-13-33(14-16-34)28(38)22(11-12-25(35)36)31-27(37)26-30-23(21-9-6-5-7-10-21)20-24(32-26)41-19-18-40-2/h5-7,9-10,20,22H,3-4,8,11-19H2,1-2H3,(H,31,37)(H,35,36)/t22-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.20	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
P2Y purinoceptor 12 (Homo sapiens (Human))	BDBM50302676 ((S)-4-(4-(2-methoxyethoxy)-6-phenylpyrimidine-2-ca...) Show SMILES CCCCCOC(=O)N1CCN(CC1)C(=O)[C@H](CCC(O)=O)NC(=O)c1nc(OCCOC)cc(n1)-c1ccccc1 |r| Show InChI InChI=1S/C29H39N5O8/c1-3-4-8-17-42-29(39)34-15-13-33(14-16-34)28(38)22(11-12-25(35)36)31-27(37)26-30-23(21-9-6-5-7-10-21)20-24(32-26)41-19-18-40-2/h5-7,9-10,20,22H,3-4,8,11-19H2,1-2H3,(H,31,37)(H,35,36)/t22-/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	>1.00E+4	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