BindingDB logo
myBDB logout

null

SMILES: COc1cc(cc(OC)c1OC)-c1cnc2[nH]c(=O)n(-c3ccc4NCCc4c3)c2c1

InChI Key: InChIKey=GZQAVTLIMZGPAE-UHFFFAOYSA-N

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 1 hit for monomerid = 354847   
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 kinase kinase 11


(Homo sapiens (Human))		BDBM354847
PNG
(US9814704, Example 124)
Show SMILES COc1cc(cc(OC)c1OC)-c1cnc2[nH]c(=O)n(-c3ccc4NCCc4c3)c2c1
Show InChI InChI=1S/C23H22N4O4/c1-29-19-10-14(11-20(30-2)21(19)31-3)15-9-18-22(25-12-15)26-23(28)27(18)16-4-5-17-13(8-16)6-7-24-17/h4-5,8-12,24H,6-7H2,1-3H3,(H,25,26,28)
PDB

NCI pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 550n/an/an/an/an/an/a



The University of Rochester

US Patent


Assay Description
200 ng (130 nM) MLK3 (Dundee, DU8313) was incubated with 1 μM inactive MKK7b (Dundee, DU703) in the presence of 2 μM cold ATP (Km) and 0.5 ...

US Patent US9814704 (2017)


BindingDB Entry DOI: 10.7270/Q27H1MRN
More data for this
Ligand-Target Pair