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SMILES: COC(=O)c1cccc(c1)-c1cc(C)c2ncc(C(N)=O)c(Nc3cccnc3)c2c1

InChI Key: InChIKey=QQVDLWFTDAQZCQ-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 153404   
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
Phosphodiesterase


(Trypanosoma brucei)		BDBM153404
PNG
(Methyl 3-(3-carbamoyl-8-methyl-4-(pyridin-3-ylamin...)
Show SMILES COC(=O)c1cccc(c1)-c1cc(C)c2ncc(C(N)=O)c(Nc3cccnc3)c2c1
Show InChI InChI=1S/C24H20N4O3/c1-14-9-17(15-5-3-6-16(10-15)24(30)31-2)11-19-21(14)27-13-20(23(25)29)22(19)28-18-7-4-8-26-12-18/h3-13H,1-2H3,(H2,25,29)(H,27,28)
PDB

UniProtKB/TrEMBL

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PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 2.60E+4n/an/an/an/a7.4n/a



Northeastern University



Assay Description
In short, recombinant TbrPDEB1 and TbrPDEB2 were assayed in 10 mM Tris pH 7.4, bovine serum albumin (0.2 mg/mL), 10 mM MgCl2, 25µM cAMP (Enzo Lifesci...

Chem Biol Drug Des 85: 549-64 (2015)


Article DOI: 10.1111/cbdd.12443
BindingDB Entry DOI: 10.7270/Q2FF3R28
More data for this
Ligand-Target Pair