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SMILES: COc1ccc(NC(=O)C(C)NC2=NC3C(C=NN3C3CCCC3)C(=O)N2)cc1

InChI Key: InChIKey=TUFVFVXQEAKXJL-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 317140   
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
High affinity cGMP-specific 3',5'-cyclic phosphodiesterase 9A


(Homo sapiens (Human))		BDBM317140
PNG
(US9617269, Compound WYQ-90-D)
Show SMILES COc1ccc(NC(=O)C(C)NC2=NC3C(C=NN3C3CCCC3)C(=O)N2)cc1 |c:16,t:12|
Show InChI InChI=1S/C20H26N6O3/c1-12(18(27)23-13-7-9-15(29-2)10-8-13)22-20-24-17-16(19(28)25-20)11-21-26(17)14-5-3-4-6-14/h7-12,14,16-17H,3-6H2,1-2H3,(H,23,27)(H2,22,24,25,28)
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KEGG

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PC cid
PC sid
UniChem
US Patent
n/an/a 0.600n/an/an/an/an/an/a



Sun Yat-Sen University; University of North Carolina at Chapel Hill

US Patent


Assay Description
Inhibition activities of all the N-substituted pyrazolo [3,4-d] pyrimidine ketone compounds according to the present invention to the phosphodiestera...

US Patent US9617269 (2017)


BindingDB Entry DOI: 10.7270/Q2RX9F4B
More data for this
Ligand-Target Pair