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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Dual specificity calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1C' and Ligand = 'BDBM50540046'   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kJ/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Dual specificity calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1C


(Homo sapiens (Human))		BDBM50540046
PNG
(CHEMBL4638381)
Show SMILES C[C@@H](Nc1nc2n(ncc2c(=O)n1Cc1ccc2OCOc2c1)C(C)(C)C)c1ccc(Cl)cc1 |r|
Show InChI InChI=1S/C25H26ClN5O3/c1-15(17-6-8-18(26)9-7-17)28-24-29-22-19(12-27-31(22)25(2,3)4)23(32)30(24)13-16-5-10-20-21(11-16)34-14-33-20/h5-12,15H,13-14H2,1-4H3,(H,28,29)/t15-/m1/s1
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 27n/an/an/an/an/an/a



Sun Yat-sen University

Curated by ChEMBL


Assay Description
Inhibition of PDE1C2 (147 to 531 residues) (unknown origin) using [3H]-cGMP substrate incubated for 15 mins by liquid scintillation counting method

J Med Chem 63: 7867-7879 (2020)


Article DOI: 10.1021/acs.jmedchem.0c00711
BindingDB Entry DOI: 10.7270/Q20V8HBZ
More data for this
Ligand-Target Pair