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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Mitogen-activated protein kinase 1' and Ligand = 'BDBM180929'   
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
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM180929
PNG
(US9133187, I-1)
Show SMILES Clc1ccc(cc1Cl)[C@H](NC(=O)N1CCc2cnc(NC3CCOCC3)nc2C1)c1cnco1 |r|
Show InChI InChI=1S/C23H24Cl2N6O3/c24-17-2-1-14(9-18(17)25)21(20-11-26-13-34-20)30-23(32)31-6-3-15-10-27-22(29-19(15)12-31)28-16-4-7-33-8-5-16/h1-2,9-11,13,16,21H,3-8,12H2,(H,30,32)(H,27,28,29)/t21-/m0/s1
PDB
MMDB

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PC cid
PC sid
UniChem
US Patent
n/an/a 1.10n/an/an/an/a7.3n/a



ARRAY BIOPHARMA INC.; GENENTECH, INC.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an n-terminal 6-His fusion pro...


US Patent US9133187 (2015)


BindingDB Entry DOI: 10.7270/Q28W3C2N
More data for this
Ligand-Target Pair