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BDBM163130 US9062026, Table III, Compound 58

SMILES: CC(=O)N1Cc2nc(nc(NCc3ccccc3)c2C1)-n1c(C)cc2ccccc12

InChI Key: InChIKey=ROBRRYPDZPRDFQ-UHFFFAOYSA-N

Data: 1 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 1 hit for monomerid = 163130   
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
Valosin containing protein, p97 subunit


(Homo sapiens (Human))
BDBM163130
PNG
(US9062026, Table III, Compound 58)
Show SMILES CC(=O)N1Cc2nc(nc(NCc3ccccc3)c2C1)-n1c(C)cc2ccccc12
Show InChI InChI=1S/C24H23N5O/c1-16-12-19-10-6-7-11-22(19)29(16)24-26-21-15-28(17(2)30)14-20(21)23(27-24)25-13-18-8-4-3-5-9-18/h3-12H,13-15H2,1-2H3,(H,25,26,27)
PDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
GoogleScholar
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a<2.00E+3n/an/an/an/a7.537



Cleave Biosciences, Inc.

US Patent


Assay Description
The ATPase assay is performed according the following protocol: Purified enzyme (20 nM p97), substrate (20 uM ATP) and a dose titration of compounds ...


US Patent US9062026 (2015)


BindingDB Entry DOI: 10.7270/Q2765D32
More data for this
Ligand-Target Pair