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SMILES: Cc1cc(C)cc(Cn2c3ccc(cc3n(C)c2=O)S(=O)(=O)NC2(C)CC2)c1

InChI Key: InChIKey=OACQRWADBBXDIX-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 = 421458   
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
Poly(ADP-ribose) glycohydrolase


(Homo sapiens (Human))
BDBM421458
PNG
(US10508086, Example 49 | US10995073, Example 49)
Show SMILES Cc1cc(C)cc(Cn2c3ccc(cc3n(C)c2=O)S(=O)(=O)NC2(C)CC2)c1
Show InChI InChI=1S/C21H25N3O3S/c1-14-9-15(2)11-16(10-14)13-24-18-6-5-17(12-19(18)23(4)20(24)25)28(26,27)22-21(3)7-8-21/h5-6,9-12,22H,7-8,13H2,1-4H3
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a 5.07E+3n/an/an/an/a



Cancer Research Technology Limited

US Patent


Assay Description
PARG In vitro assays were conducted in a total volume of 15 ul in a standard 384 well format. 5 ul of Human Full Length PARG (Produced internally by ...


US Patent US10995073 (2021)


BindingDB Entry DOI: 10.7270/Q28K7D68
More data for this
Ligand-Target Pair
Poly(ADP-ribose) glycohydrolase


(Homo sapiens (Human))
BDBM421458
PNG
(US10508086, Example 49 | US10995073, Example 49)
Show SMILES Cc1cc(C)cc(Cn2c3ccc(cc3n(C)c2=O)S(=O)(=O)NC2(C)CC2)c1
Show InChI InChI=1S/C21H25N3O3S/c1-14-9-15(2)11-16(10-14)13-24-18-6-5-17(12-19(18)23(4)20(24)25)28(26,27)22-21(3)7-8-21/h5-6,9-12,22H,7-8,13H2,1-4H3
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a 5.07E+3n/an/an/an/a



Cancer Research Technology Limited

US Patent


Assay Description
PARG In vitro assays were conducted in a total volume of 15 ul in a standard 384 well format. 5 ul of Human Full Length PARG (Produced internally by ...


US Patent US10508086 (2019)


BindingDB Entry DOI: 10.7270/Q26112QF
More data for this
Ligand-Target Pair