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SMILES: COc1ccc(cc1OC)S(=O)(=O)NCc1cccc(c1)C(=O)NCCC1CCCNC1

InChI Key: InChIKey=IGYQFVWVGPSQED-UHFFFAOYSA-N

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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 = 50308883   
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))		BDBM50308883
PNG
(3-[(3,4-Dimethoxy-benzenesulfonylamino)-methyl]-N-...)
Show SMILES COc1ccc(cc1OC)S(=O)(=O)NCc1cccc(c1)C(=O)NCCC1CCCNC1
Show InChI InChI=1S/C23H31N3O5S/c1-30-21-9-8-20(14-22(21)31-2)32(28,29)26-16-18-5-3-7-19(13-18)23(27)25-12-10-17-6-4-11-24-15-17/h3,5,7-9,13-14,17,24,26H,4,6,10-12,15-16H2,1-2H3,(H,25,27)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a>6.00E+6n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of human ROCK2 by IMAP assay

J Med Chem 53: 759-77 (2010)


Article DOI: 10.1021/jm9014263
BindingDB Entry DOI: 10.7270/Q2V125RD
More data for this
Ligand-Target Pair