BindingDB logo
myBDB logout

null

SMILES: Cc1nc(c[nH]1)C(=O)Nc1ccc(cc1)-c1n[nH]c(=O)c2ccccc12

InChI Key: InChIKey=YWTMQFORMCOXKA-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 2 hits for monomerid = 380247   
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))
BDBM380247
PNG
(2-methyl-N-[4-(4-oxo- 3,4-dihydrophthalazin-1- yl)...)
Show SMILES Cc1nc(c[nH]1)C(=O)Nc1ccc(cc1)-c1n[nH]c(=O)c2ccccc12
Show InChI InChI=1S/C19H15N5O2/c1-11-20-10-16(21-11)19(26)22-13-8-6-12(7-9-13)17-14-4-2-3-5-15(14)18(25)24-23-17/h2-10H,1H3,(H,20,21)(H,22,26)(H,24,25)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a<100n/an/an/an/an/an/a



University of Illinois at Chicago



Assay Description
The effectiveness of compounds of the present invention as ROCK inhibitors can be determined in a 30 μL assay containing 20 mM HEPES, pH 7.5, 20...


J Med Chem 51: 3437-48 (2008)


BindingDB Entry DOI: 10.7270/Q2445PSQ
More data for this
Ligand-Target Pair
Rho-associated protein kinase 1


(Homo sapiens (Human))
BDBM380247
PNG
(2-methyl-N-[4-(4-oxo- 3,4-dihydrophthalazin-1- yl)...)
Show SMILES Cc1nc(c[nH]1)C(=O)Nc1ccc(cc1)-c1n[nH]c(=O)c2ccccc12
Show InChI InChI=1S/C19H15N5O2/c1-11-20-10-16(21-11)19(26)22-13-8-6-12(7-9-13)17-14-4-2-3-5-15(14)18(25)24-23-17/h2-10H,1H3,(H,20,21)(H,22,26)(H,24,25)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 550n/an/an/an/an/an/a



University of Illinois at Chicago



Assay Description
The effectiveness of compounds of the present invention as ROCK inhibitors can be determined in a 30 μL assay containing 20 mM HEPES, pH 7.5, 20...


J Med Chem 51: 3437-48 (2008)


BindingDB Entry DOI: 10.7270/Q2445PSQ
More data for this
Ligand-Target Pair