BindingDB logo
myBDB logout

BDBM281111 US10022354, Example 51

SMILES: CC(C)c1cc([nH]n1)C(=O)N1CCC(C1)c1cccc(C)n1

InChI Key: InChIKey=NHBZYMIMOIDLJM-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 = 281111   
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
Lysine-specific demethylase 5A


(Homo sapiens (Human))
BDBM281111
PNG
(US10022354, Example 51)
Show SMILES CC(C)c1cc([nH]n1)C(=O)N1CCC(C1)c1cccc(C)n1
Show InChI InChI=1S/C17H22N4O/c1-11(2)15-9-16(20-19-15)17(22)21-8-7-13(10-21)14-6-4-5-12(3)18-14/h4-6,9,11,13H,7-8,10H2,1-3H3,(H,19,20)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 2.40n/an/an/an/a7.025



Genentech Inc

US Patent


Assay Description
Full length KDM5A enzyme was expressed and purified inhouse. Biotin-H3K4me3 peptide was purchased from New England Biolabs. HTRF reagents (containing...


US Patent US10022354 (2018)


BindingDB Entry DOI: 10.7270/Q2PC34F7
More data for this
Ligand-Target Pair