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SMILES: COc1ccc(cc1OC)C(=O)Nc1cccc(c1)C(=O)NCCC1CCCNC1

InChI Key: InChIKey=HNVYIUBBLSZTTN-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50308884   
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))		BDBM50308884
PNG
(3,4-Dimethoxy-N-[3-(2-piperidin-3-yl-ethylcarbamoy...)
Show SMILES COc1ccc(cc1OC)C(=O)Nc1cccc(c1)C(=O)NCCC1CCCNC1
Show InChI InChI=1S/C23H29N3O4/c1-29-20-9-8-18(14-21(20)30-2)23(28)26-19-7-3-6-17(13-19)22(27)25-12-10-16-5-4-11-24-15-16/h3,6-9,13-14,16,24H,4-5,10-12,15H2,1-2H3,(H,25,27)(H,26,28)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
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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