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BDBM74535 9-chloranyl-N-(3-methylbutyl)-2,3-dihydro-1H-cyclopenta[b]quinoline-6-carboxamide::9-chloro-N-(3-methylbutyl)-2,3-dihydro-1H-cyclopenta[b]quinoline-6-carboxamide::9-chloro-N-isoamyl-2,3-dihydro-1H-cyclopenta[b]quinoline-6-carboxamide::MLS001199339::SMR000562995::cid_20873747

SMILES: CC(C)CCNC(=O)c1ccc2c(Cl)c3CCCc3nc2c1

InChI Key: InChIKey=DJDSAOCYFZVIHY-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 = 74535   
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
Hematopoietic cell protein-tyrosine phosphatase 70Z-PEP


(Homo sapiens (Human))
BDBM74535
PNG
(9-chloranyl-N-(3-methylbutyl)-2,3-dihydro-1H-cyclo...)
Show SMILES CC(C)CCNC(=O)c1ccc2c(Cl)c3CCCc3nc2c1
Show InChI InChI=1S/C18H21ClN2O/c1-11(2)8-9-20-18(22)12-6-7-14-16(10-12)21-15-5-3-4-13(15)17(14)19/h6-7,10-11H,3-5,8-9H2,1-2H3,(H,20,22)
PDB

UniProtKB/SwissProt

antibodypedia
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PC cid
PC sid
UniChem

Similars

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
Hematopoietic cell protein-tyrosine phosphatase 70Z-PEP


(Homo sapiens (Human))
BDBM74535
PNG
(9-chloranyl-N-(3-methylbutyl)-2,3-dihydro-1H-cyclo...)
Show SMILES CC(C)CCNC(=O)c1ccc2c(Cl)c3CCCc3nc2c1
Show InChI InChI=1S/C18H21ClN2O/c1-11(2)8-9-20-18(22)12-6-7-14-16(10-12)21-15-5-3-4-13(15)17(14)19/h6-7,10-11H,3-5,8-9H2,1-2H3,(H,20,22)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

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
Hematopoietic protein-tyrosine phosphatase (HEPTP)


(Homo sapiens (Human))
BDBM74535
PNG
(9-chloranyl-N-(3-methylbutyl)-2,3-dihydro-1H-cyclo...)
Show SMILES CC(C)CCNC(=O)c1ccc2c(Cl)c3CCCc3nc2c1
Show InChI InChI=1S/C18H21ClN2O/c1-11(2)8-9-20-18(22)12-6-7-14-16(10-12)21-15-5-3-4-13(15)17(14)19/h6-7,10-11H,3-5,8-9H2,1-2H3,(H,20,22)
PDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

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