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SMILES: Oc1cccc(c1)-c1cnc2[nH]ccc2n1

InChI Key: InChIKey=CIPWNJAUZQQQOH-UHFFFAOYSA-N

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   Substructure
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50127023   
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))
BDBM50127023
PNG
(CHEMBL3628251)
Show SMILES Oc1cccc(c1)-c1cnc2[nH]ccc2n1
Show InChI InChI=1S/C12H9N3O/c16-9-3-1-2-8(6-9)11-7-14-12-10(15-11)4-5-13-12/h1-7,16H,(H,13,14)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a>2.00E+5n/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of ERK2 (unknown origin) using 5FAM-IPTSPITTTYFFFKKK as substrate after 1 hr by LC3K assay


Bioorg Med Chem Lett 25: 4728-32 (2015)


BindingDB Entry DOI: 10.7270/Q2TB18QM
More data for this
Ligand-Target Pair