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SMILES: COc1nc(cc(n1)-n1nc(C)nc1C(C)O)N1CC(C1)c1nc2ccccc2n1C

InChI Key: InChIKey=GAOUBBRHRTXPQP-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 244136   
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
Isoform PDE10A2 of cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A (PDE10A2)


(Homo sapiens (Human))		BDBM244136
PNG
(US9428492, 9)
Show SMILES COc1nc(cc(n1)-n1nc(C)nc1C(C)O)N1CC(C1)c1nc2ccccc2n1C
Show InChI InChI=1S/C21H24N8O2/c1-12(30)19-22-13(2)26-29(19)18-9-17(24-21(25-18)31-4)28-10-14(11-28)20-23-15-7-5-6-8-16(15)27(20)3/h5-9,12,14,30H,10-11H2,1-4H3
PDB

UniProtKB/SwissProt

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PC cid
PC sid
UniChem
US Patent
 1.20 -12.2n/an/an/an/an/a7.225



Merck Sharp & Dohme Corp.

US Patent


Assay Description
The fluorescence polarization assay for cyclic nucleotide phosphodiesterases was performed using an IMAP® FP kit supplied by Molecular Devices, S...

US Patent US9428492 (2016)


BindingDB Entry DOI: 10.7270/Q2HD7TKM
More data for this
Ligand-Target Pair