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BDBM92140 erk000586

SMILES: Cc1ccc(Nc2ncc(C)c(n2)-c2c[nH]c(c2)C(=O)N[C@H](CO)c2cccc(C)c2)cc1

InChI Key: InChIKey=CASRARBEEOTSNY-HSZRJFAPSA-N

Data: 2 KI

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 92140   
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
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM92140
PNG
(erk000586)
Show SMILES Cc1ccc(Nc2ncc(C)c(n2)-c2c[nH]c(c2)C(=O)N[C@H](CO)c2cccc(C)c2)cc1
Show InChI InChI=1S/C26H27N5O2/c1-16-7-9-21(10-8-16)29-26-28-13-18(3)24(31-26)20-12-22(27-14-20)25(33)30-23(15-32)19-6-4-5-17(2)11-19/h4-14,23,27,32H,15H2,1-3H3,(H,30,33)(H,28,29,31)/t23-/m1/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
D3R
2n/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))
BDBM92140
PNG
(erk000586)
Show SMILES Cc1ccc(Nc2ncc(C)c(n2)-c2c[nH]c(c2)C(=O)N[C@H](CO)c2cccc(C)c2)cc1
Show InChI InChI=1S/C26H27N5O2/c1-16-7-9-21(10-8-16)29-26-28-13-18(3)24(31-26)20-12-22(27-14-20)25(33)30-23(15-32)19-6-4-5-17(2)11-19/h4-14,23,27,32H,15H2,1-3H3,(H,30,33)(H,28,29,31)/t23-/m1/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
2n/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