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SMILES: CC1(CC1)NS(=O)(=O)c1ccc2CCN(C(=O)CN3CCOC3=O)c2c1

InChI Key: InChIKey=QMHBFTDPSONVFY-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 6 hits for monomerid = 421423   
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))
BDBM421423
PNG
(N-(1-Methylcyclopropyl)-1-[2-(2-oxooxazolidin-3-yl...)
Show SMILES CC1(CC1)NS(=O)(=O)c1ccc2CCN(C(=O)CN3CCOC3=O)c2c1
Show InChI InChI=1S/C17H21N3O5S/c1-17(5-6-17)18-26(23,24)13-3-2-12-4-7-20(14(12)10-13)15(21)11-19-8-9-25-16(19)22/h2-3,10,18H,4-9,11H2,1H3
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a 4.28E+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
ADP-ribosylhydrolase ARH3


(Homo sapiens (Human))
BDBM421423
PNG
(N-(1-Methylcyclopropyl)-1-[2-(2-oxooxazolidin-3-yl...)
Show SMILES CC1(CC1)NS(=O)(=O)c1ccc2CCN(C(=O)CN3CCOC3=O)c2c1
Show InChI InChI=1S/C17H21N3O5S/c1-17(5-6-17)18-26(23,24)13-3-2-12-4-7-20(14(12)10-13)15(21)11-19-8-9-25-16(19)22/h2-3,10,18H,4-9,11H2,1H3
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a>1.50E+5n/an/an/an/an/an/a



Cancer Research Technology Limited

US Patent


Assay Description
ARH3 In vitro selectivity assays were conducted in a total volume of 15 ul in a standard 384 well format. 5 ul of Human Full Length ARH3 (Enzo Life S...


US Patent US10508086 (2019)


BindingDB Entry DOI: 10.7270/Q26112QF
More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 1


(Homo sapiens (Human))
BDBM421423
PNG
(N-(1-Methylcyclopropyl)-1-[2-(2-oxooxazolidin-3-yl...)
Show SMILES CC1(CC1)NS(=O)(=O)c1ccc2CCN(C(=O)CN3CCOC3=O)c2c1
Show InChI InChI=1S/C17H21N3O5S/c1-17(5-6-17)18-26(23,24)13-3-2-12-4-7-20(14(12)10-13)15(21)11-19-8-9-25-16(19)22/h2-3,10,18H,4-9,11H2,1H3
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a>1.50E+5n/an/an/an/an/an/a



Cancer Research Technology Limited

US Patent


Assay Description
PARP1 In vitro selectivity assays were conducted as a 10 ul reaction volume in a NUNC Maxisorp 384-well assay plate pre-coated in-house with Histones...


US Patent US10995073 (2021)

More data for this
Ligand-Target Pair
Poly(ADP-ribose) glycohydrolase


(Homo sapiens (Human))
BDBM421423
PNG
(N-(1-Methylcyclopropyl)-1-[2-(2-oxooxazolidin-3-yl...)
Show SMILES CC1(CC1)NS(=O)(=O)c1ccc2CCN(C(=O)CN3CCOC3=O)c2c1
Show InChI InChI=1S/C17H21N3O5S/c1-17(5-6-17)18-26(23,24)13-3-2-12-4-7-20(14(12)10-13)15(21)11-19-8-9-25-16(19)22/h2-3,10,18H,4-9,11H2,1H3
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a 4.28E+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)

More data for this
Ligand-Target Pair
ADP-ribosylhydrolase ARH3


(Homo sapiens (Human))
BDBM421423
PNG
(N-(1-Methylcyclopropyl)-1-[2-(2-oxooxazolidin-3-yl...)
Show SMILES CC1(CC1)NS(=O)(=O)c1ccc2CCN(C(=O)CN3CCOC3=O)c2c1
Show InChI InChI=1S/C17H21N3O5S/c1-17(5-6-17)18-26(23,24)13-3-2-12-4-7-20(14(12)10-13)15(21)11-19-8-9-25-16(19)22/h2-3,10,18H,4-9,11H2,1H3
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a>1.50E+5n/an/an/an/an/an/a



Cancer Research Technology Limited

US Patent


Assay Description
ARH3 In vitro selectivity assays were conducted in a total volume of 15 ul in a standard 384 well format. 5 ul of Human Full Length ARH3 (Enzo Life S...


US Patent US10995073 (2021)

More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 1


(Homo sapiens (Human))
BDBM421423
PNG
(N-(1-Methylcyclopropyl)-1-[2-(2-oxooxazolidin-3-yl...)
Show SMILES CC1(CC1)NS(=O)(=O)c1ccc2CCN(C(=O)CN3CCOC3=O)c2c1
Show InChI InChI=1S/C17H21N3O5S/c1-17(5-6-17)18-26(23,24)13-3-2-12-4-7-20(14(12)10-13)15(21)11-19-8-9-25-16(19)22/h2-3,10,18H,4-9,11H2,1H3
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a>1.50E+5n/an/an/an/an/an/a



Cancer Research Technology Limited

US Patent


Assay Description
PARP1 In vitro selectivity assays were conducted as a 10 ul reaction volume in a NUNC Maxisorp 384-well assay plate pre-coated in-house with Histones...


US Patent US10508086 (2019)


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