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1 similar compounds to monomer 50232690

Compile data set for download or QSAR
Wt: 419.5
BDBM50232700

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50232700   
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
Sigma non-opioid intracellular receptor 1


(Cavia porcellus (Guinea pig))
BDBM50232700
PNG
(CHEMBL4099261)
Show SMILES CCCN1CCN(CC1)c1ccc2[C@H]3C[C@@H](CCN3C(=O)OCc3ccccc3)c2c1
Show InChI InChI=1S/C26H33N3O2/c1-2-11-27-13-15-28(16-14-27)22-8-9-23-24(18-22)21-10-12-29(25(23)17-21)26(30)31-19-20-6-4-3-5-7-20/h3-9,18,21,25H,2,10-17,19H2,1H3/t21-,25-/m1/s1
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem

Similars

Article
PubMed
8.70n/an/an/an/an/an/an/an/a



The University of Texas at Austin

Curated by ChEMBL


Assay Description
Displacement of [3H]-(+)-pentazocine from guinea pig brain sigma1 receptor by PDSP assay


ACS Med Chem Lett 8: 455-460 (2017)


Article DOI: 10.1021/acsmedchemlett.7b00066
More data for this
Ligand-Target Pair
Sigma-2 receptor


(Rattus norvegicus (Rat))
BDBM50232700
PNG
(CHEMBL4099261)
Show SMILES CCCN1CCN(CC1)c1ccc2[C@H]3C[C@@H](CCN3C(=O)OCc3ccccc3)c2c1
Show InChI InChI=1S/C26H33N3O2/c1-2-11-27-13-15-28(16-14-27)22-8-9-23-24(18-22)21-10-12-29(25(23)17-21)26(30)31-19-20-6-4-3-5-7-20/h3-9,18,21,25H,2,10-17,19H2,1H3/t21-,25-/m1/s1
UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem

Similars

Article
PubMed
29n/an/an/an/an/an/an/an/a



The University of Texas at Austin

Curated by ChEMBL


Assay Description
Displacement of [3H]-ditolylguanidine from sigma2 receptor in rat PC12 cells in presence of (+)-pentazocine by PDSP assay


ACS Med Chem Lett 8: 455-460 (2017)


Article DOI: 10.1021/acsmedchemlett.7b00066
More data for this
Ligand-Target Pair