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BDBM316092 US9616064, Compound 24c

SMILES: Nc1nccc(n1)-n1ccc2c(cccc12)C(=O)NCCc1ccccc1

InChI Key: InChIKey=NDMKTJWCSWYAME-UHFFFAOYSA-N

Data: 2 IC50

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 = 316092   
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))
BDBM316092
PNG
(US9616064, Compound 24c)
Show SMILES Nc1nccc(n1)-n1ccc2c(cccc12)C(=O)NCCc1ccccc1
Show InChI InChI=1S/C21H19N5O/c22-21-24-13-10-19(25-21)26-14-11-16-17(7-4-8-18(16)26)20(27)23-12-9-15-5-2-1-3-6-15/h1-8,10-11,13-14H,9,12H2,(H,23,27)(H2,22,24,25)
PDB
MMDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 500n/an/an/an/an/an/a



H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC.

US Patent




US Patent US9616064 (2017)


BindingDB Entry DOI: 10.7270/Q2KD2106
More data for this
Ligand-Target Pair
Rho-associated protein kinase 1


(Homo sapiens (Human))
BDBM316092
PNG
(US9616064, Compound 24c)
Show SMILES Nc1nccc(n1)-n1ccc2c(cccc12)C(=O)NCCc1ccccc1
Show InChI InChI=1S/C21H19N5O/c22-21-24-13-10-19(25-21)26-14-11-16-17(7-4-8-18(16)26)20(27)23-12-9-15-5-2-1-3-6-15/h1-8,10-11,13-14H,9,12H2,(H,23,27)(H2,22,24,25)
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 2.00E+3n/an/an/an/an/an/a



H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC.

US Patent


Assay Description
The inventors undertook a screen of the NCI Diversity set using a Z-lyte FRET assay (Kang et al. (2009); Wu et al. (2010)) to measure kinase inhibiti...


US Patent US9616064 (2017)


BindingDB Entry DOI: 10.7270/Q2KD2106
More data for this
Ligand-Target Pair