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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Mitogen-activated protein kinase 1' and Ligand = 'BDBM92123'   
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))
BDBM92123
PNG
(erk000559)
Show SMILES Cc1cnc(Nc2cc(Cl)cc(Cl)c2)nc1-c1c[nH]c(c1)C(=O)N[C@H](CO)c1ccccc1
Show InChI InChI=1S/C24H21Cl2N5O2/c1-14-11-28-24(29-19-9-17(25)8-18(26)10-19)31-22(14)16-7-20(27-12-16)23(33)30-21(13-32)15-5-3-2-4-6-15/h2-12,21,27,32H,13H2,1H3,(H,30,33)(H,28,29,31)/t21-/m1/s1
PDB
MMDB

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KEGG

UniProtKB/SwissProt

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PC cid
PC sid
UniChem
D3R
3n/an/an/an/an/an/an/an/a



D3R



Assay Description
Photometric_Method2


D3R 222: (2015)


BindingDB Entry DOI: 10.7270/Q2S46QSD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM92123
PNG
(erk000559)
Show SMILES Cc1cnc(Nc2cc(Cl)cc(Cl)c2)nc1-c1c[nH]c(c1)C(=O)N[C@H](CO)c1ccccc1
Show InChI InChI=1S/C24H21Cl2N5O2/c1-14-11-28-24(29-19-9-17(25)8-18(26)10-19)31-22(14)16-7-20(27-12-16)23(33)30-21(13-32)15-5-3-2-4-6-15/h2-12,21,27,32H,13H2,1H3,(H,30,33)(H,28,29,31)/t21-/m1/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
3n/an/an/an/an/an/an/an/a



CSAR



Assay Description
Assay 1 ...


CSAR 1: (2012)


Article DOI: 10.1021/acs.biochem.6b00786
More data for this
Ligand-Target Pair