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Compile Data Set for Download or QSAR

Found 1 hit of ki for monomerid = 50098831   
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
Leukocyte elastase


(Homo sapiens (Human))
BDBM50098831
PNG
(CHEMBL23952 | N-[1-(5-tert-Butyl-[1,3,4]oxadiazole...)
Show SMILES CC(C)[C@H](NC(=O)CN1c2ccccc2C(=NCC1=O)c1ccc(Cl)cc1)C(=O)c1nnc(o1)C(C)(C)C |c:16|
Show InChI InChI=1S/C28H30ClN5O4/c1-16(2)23(25(37)26-32-33-27(38-26)28(3,4)5)31-21(35)15-34-20-9-7-6-8-19(20)24(30-14-22(34)36)17-10-12-18(29)13-11-17/h6-13,16,23H,14-15H2,1-5H3,(H,31,35)/t23-/m0/s1
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Patents

PubMed
57.8n/an/an/an/an/an/an/an/a



Cortech, Inc.

Curated by ChEMBL


Assay Description
Binding constant derived from inhibition of elastase catalyzed hydrolysis of synthetic substrate


J Med Chem 44: 1268-85 (2001)


BindingDB Entry DOI: 10.7270/Q2B858VW
More data for this
Ligand-Target Pair