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BDBM50442812 CHEMBL2440735

SMILES: NCc1ccc(cc1-c1cccc(c1)C(=O)OCCO)C(=O)Nc1ccncc1F

InChI Key: InChIKey=OFEAPRLJSLGEFJ-UHFFFAOYSA-N

Data: 1 IC50

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50442812   
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
Rho-associated protein kinase 2


(Homo sapiens (Human))
BDBM50442812
PNG
(CHEMBL2440735)
Show SMILES NCc1ccc(cc1-c1cccc(c1)C(=O)OCCO)C(=O)Nc1ccncc1F
Show InChI InChI=1S/C22H20FN3O4/c23-19-13-25-7-6-20(19)26-21(28)15-4-5-17(12-24)18(11-15)14-2-1-3-16(10-14)22(29)30-9-8-27/h1-7,10-11,13,27H,8-9,12,24H2,(H,25,26,28)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.40n/an/an/an/an/an/a



Amakem N.V.

Curated by ChEMBL


Assay Description
Inhibition of ROCK2 (unknown origin) using long S6 kinase peptide as substrate by radiometric assay


Bioorg Med Chem Lett 23: 6442-6 (2013)


Article DOI: 10.1016/j.bmcl.2013.09.040
BindingDB Entry DOI: 10.7270/Q2BC411W
More data for this
Ligand-Target Pair