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BDBM74464 3-(5-chloro-1,3-diketo-3a,4,7,7a-tetrahydroisoindol-2-yl)-N-(2-furfuryl)propionamide::3-(5-chloro-1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-isoindol-2-yl)-N-(2-furylmethyl)propanamide::3-(5-chloro-1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)-N-(2-furanylmethyl)propanamide::3-(5-chloro-1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)-N-(furan-2-ylmethyl)propanamide::3-[5-chloranyl-1,3-bis(oxidanylidene)-3a,4,7,7a-tetrahydroisoindol-2-yl]-N-(furan-2-ylmethyl)propanamide::MLS000066821::SMR000070990::cid_2900724

SMILES: ClC1=CCC2C(C1)C(=O)N(CCC(=O)NCc1ccco1)C2=O

InChI Key: InChIKey=MIXDWOPDCUBBSA-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 74464   
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
Tyrosine-protein phosphatase non-receptor type 22


(Homo sapiens (Human))
BDBM74464
PNG
(3-(5-chloro-1,3-diketo-3a,4,7,7a-tetrahydroisoindo...)
Show SMILES ClC1=CCC2C(C1)C(=O)N(CCC(=O)NCc1ccco1)C2=O |t:1|
Show InChI InChI=1S/C16H17ClN2O4/c17-10-3-4-12-13(8-10)16(22)19(15(12)21)6-5-14(20)18-9-11-2-1-7-23-11/h1-3,7,12-13H,4-6,8-9H2,(H,18,20)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
PCBioAssay
n/an/a>7.94E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q24748BK
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 22


(Homo sapiens (Human))
BDBM74464
PNG
(3-(5-chloro-1,3-diketo-3a,4,7,7a-tetrahydroisoindo...)
Show SMILES ClC1=CCC2C(C1)C(=O)N(CCC(=O)NCc1ccco1)C2=O |t:1|
Show InChI InChI=1S/C16H17ClN2O4/c17-10-3-4-12-13(8-10)16(22)19(15(12)21)6-5-14(20)18-9-11-2-1-7-23-11/h1-3,7,12-13H,4-6,8-9H2,(H,18,20)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
PCBioAssay
n/an/a>7.94E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2CR5RTC
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 7


(Homo sapiens (Human))
BDBM74464
PNG
(3-(5-chloro-1,3-diketo-3a,4,7,7a-tetrahydroisoindo...)
Show SMILES ClC1=CCC2C(C1)C(=O)N(CCC(=O)NCc1ccco1)C2=O |t:1|
Show InChI InChI=1S/C16H17ClN2O4/c17-10-3-4-12-13(8-10)16(22)19(15(12)21)6-5-14(20)18-9-11-2-1-7-23-11/h1-3,7,12-13H,4-6,8-9H2,(H,18,20)
PDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
PCBioAssay
n/an/a>7.94E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2VQ314Z
More data for this
Ligand-Target Pair