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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Procathepsin L' and Ligand = 'BDBM50263607'   
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
Procathepsin L


(Homo sapiens (Human))		BDBM50263607
PNG
(CHEMBL4074099)
Show SMILES FC(F)(F)Oc1ccc(C[C@H](NC(=O)c2cnn(n2)C2COC2)C(=O)NC2(CC2)C#N)cc1Cl |r|
Show InChI InChI=1S/C20H18ClF3N6O4/c21-13-5-11(1-2-16(13)34-20(22,23)24)6-14(18(32)28-19(10-25)3-4-19)27-17(31)15-7-26-30(29-15)12-8-33-9-12/h1-2,5,7,12,14H,3-4,6,8-9H2,(H,27,31)(H,28,32)/t14-/m0/s1
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Article
PubMed
 25n/an/an/an/an/an/an/an/a



Laboratorium für Organische Chemie , ETH Zurich , Vladimir-Prelog-Weg 3 , 8093 Zürich , Switzerland.

Curated by ChEMBL


Assay Description
Inhibition of human CatL using Cbz-Phe-Arg-AMC as substrate measured over 30 mins by fluorimetric method

J Med Chem 61: 3370-3388 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01870
BindingDB Entry DOI: 10.7270/Q2MC92GH
More data for this
Ligand-Target Pair