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BDBM260839 US9540323, 25::US9540323, example 25

SMILES: CCC1(CC)CN(c2c1c(ccc2O)C(F)(F)F)c1ccccc1NC(=O)Nc1ccc(cc1)C1CCN(CC(C)(C)C)CC1

InChI Key: InChIKey=YOAXDDFKBHXOCT-UHFFFAOYSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 260839   
Target/Host
(Institution)		LigandTarget/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		pHTemp
°C
Purinergic receptor P2Y1


(Homo sapiens (Human))		BDBM260839
PNG
(US9540323, 25 | US9540323, example 25)
Show SMILES CCC1(CC)CN(c2c1c(ccc2O)C(F)(F)F)c1ccccc1NC(=O)Nc1ccc(cc1)C1CCN(CC(C)(C)C)CC1
Show InChI InChI=1S/C36H45F3N4O2/c1-6-35(7-2)23-43(32-30(44)17-16-27(31(32)35)36(37,38)39)29-11-9-8-10-28(29)41-33(45)40-26-14-12-24(13-15-26)25-18-20-42(21-19-25)22-34(3,4)5/h8-17,25,44H,6-7,18-23H2,1-5H3,(H2,40,41,45)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
 6.30 -11.2n/an/an/an/an/a7.425



Bristol-Myers Squibb Company

US Patent


Assay Description
A SPA membrane binding assay was used to identify inhibitors of [33P] 2MeS-ADP binding to cloned human P2Y1 receptors (The P2Y1 receptor membranes we...

US Patent US9540323 (2017)


BindingDB Entry DOI: 10.7270/Q289141P
More data for this
Ligand-Target Pair