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SMILES: NC(Sc1ccccc1N)C(C#N)c1ccccc1

InChI Key: InChIKey=PGYGUZVDSJJBOU-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50141403   
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
Dual specificity mitogen-activated protein kinase kinase 1


(Homo sapiens (Human))
BDBM50141403
PNG
(3-Amino-3-(2-amino-phenylsulfanyl)-2-phenyl-propio...)
Show SMILES NC(Sc1ccccc1N)C(C#N)c1ccccc1
Show InChI InChI=1S/C15H15N3S/c16-10-12(11-6-2-1-3-7-11)15(18)19-14-9-5-4-8-13(14)17/h1-9,12,15H,17-18H2
PDB
MMDB

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PC cid
PC sid
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Article
PubMed
n/an/a 140n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceuticals Research Institute

Curated by ChEMBL


Assay Description
Inhibitory potency against mitogen activated protein kinase kinase kinase 1


Bioorg Med Chem Lett 14: 1483-6 (2004)


Article DOI: 10.1016/j.bmcl.2004.01.012
BindingDB Entry DOI: 10.7270/Q2H131F0
More data for this
Ligand-Target Pair