null

SMILES: CC1(C)CN(c2c1c(Cl)ccc2O)c1ccccc1NC(=O)Nc1nc2ccc(Cl)nc2s1

InChI Key: InChIKey=QGMKJGGBQPKFEZ-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50045607   

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 1 (Homo sapiens (Human))	BDBM50045607 (CHEMBL3314287) Show SMILES CC1(C)CN(c2c1c(Cl)ccc2O)c1ccccc1NC(=O)Nc1nc2ccc(Cl)nc2s1 Show InChI InChI=1S/C23H19Cl2N5O2S/c1-23(2)11-30(19-16(31)9-7-12(24)18(19)23)15-6-4-3-5-13(15)26-21(32)29-22-27-14-8-10-17(25)28-20(14)33-22/h3-10,31H,11H2,1-2H3,(H2,26,27,29,32)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	0.140	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Research Curated by ChEMBL					Assay Description Antagonist activity at P2Y1 receptor in washed human platelets assessed as 1 uM 2-methylthio-ADP-induced calcium flux by FLIPR assay				J Med Chem 57: 6150-64 (2014) Article DOI: 10.1021/jm5006226 BindingDB Entry DOI: 10.7270/Q20Z74XP
					More data for this Ligand-Target Pair
P2Y purinoceptor 1 (Homo sapiens (Human))	BDBM50045607 (CHEMBL3314287) Show SMILES CC1(C)CN(c2c1c(Cl)ccc2O)c1ccccc1NC(=O)Nc1nc2ccc(Cl)nc2s1 Show InChI InChI=1S/C23H19Cl2N5O2S/c1-23(2)11-30(19-16(31)9-7-12(24)18(19)23)15-6-4-3-5-13(15)26-21(32)29-22-27-14-8-10-17(25)28-20(14)33-22/h3-10,31H,11H2,1-2H3,(H2,26,27,29,32)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Research Curated by ChEMBL					Assay Description Antagonist activity at P2Y1 receptor in platelet-enriched human plasma assessed as 10 uM ADP-induced platelet aggregation preincubated for 1 min foll...				J Med Chem 57: 6150-64 (2014) Article DOI: 10.1021/jm5006226 BindingDB Entry DOI: 10.7270/Q20Z74XP
					More data for this Ligand-Target Pair