BDBM50045605 CHEMBL3314319::US9428504, 157

SMILES: CC(C)(C)CN1CCC2(CN(c3c2c(c(F)cc3O)-c2ccc(Cl)cc2)c2ccccc2NC(=O)Nc2ccc(OC(F)(F)F)cc2)CC1

InChI Key: InChIKey=NQRMASQBYCUBKZ-UHFFFAOYSA-N

Data: 1 KI  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 3 hits for monomerid = 50045605   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
P2Y purinoceptor 1 (Human)	BDBM50045605 (CHEMBL3314319 | US9428504, 157) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	0.160	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
P2Y purinoceptor 1 (Human)	BDBM50045605 (CHEMBL3314319 | US9428504, 157) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	200	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
P2Y purinoceptor 1 (Human)	BDBM50045605 (CHEMBL3314319 | US9428504, 157) Show SMILES Show InChI	GoogleScholar	UniChem		12.3	-10.8	n/a	n/a	n/a	n/a	n/a	7.4	25
TBA									Citation and Details
					More data for this Ligand-Target Pair