BindingDB logo
myBDB logout

BDBM142644 US8937058, 11A

SMILES: CC[C@]12CC[C@@H]3[C@H]4CCC(=O)C=C4C[C@@H](C4CC4)[C@H]3[C@@H]1CC[C@]21OC(=O)C=C1

InChI Key: InChIKey=VVMUECDKKOQFSV-LDQMMROCSA-N

Data: 2 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 2 hits for monomerid = 142644   
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
Androgen receptor


(Homo sapiens (Human))
BDBM142644
PNG
(US8937058, 11A)
Show SMILES CC[C@]12CC[C@@H]3[C@H]4CCC(=O)C=C4C[C@@H](C4CC4)[C@H]3[C@@H]1CC[C@]21OC(=O)C=C1 |r,c:11,31|
Show InChI InChI=1S/C25H32O3/c1-2-24-10-7-19-18-6-5-17(26)13-16(18)14-20(15-3-4-15)23(19)21(24)8-11-25(24)12-9-22(27)28-25/h9,12-13,15,18-21,23H,2-8,10-11,14H2,1H3/t18-,19+,20-,21-,23-,24-,25+/m0/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 94n/an/an/an/an/an/a



TBA

US Patent


Assay Description
The test was carried out as in 1., with the following modifications: cytosol from androgen receptor-expressing insect cells (Hi5) was used, and the r...


US Patent US8937058 (2015)


BindingDB Entry DOI: 10.7270/Q2N29VNG
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM142644
PNG
(US8937058, 11A)
Show SMILES CC[C@]12CC[C@@H]3[C@H]4CCC(=O)C=C4C[C@@H](C4CC4)[C@H]3[C@@H]1CC[C@]21OC(=O)C=C1 |r,c:11,31|
Show InChI InChI=1S/C25H32O3/c1-2-24-10-7-19-18-6-5-17(26)13-16(18)14-20(15-3-4-15)23(19)21(24)8-11-25(24)12-9-22(27)28-25/h9,12-13,15,18-21,23H,2-8,10-11,14H2,1H3/t18-,19+,20-,21-,23-,24-,25+/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 500n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Using cytosol from progesterone receptor-expressing insect cells (Hi5), competitive binding to the progesterone receptor was determined from the abil...


US Patent US8937058 (2015)


BindingDB Entry DOI: 10.7270/Q2N29VNG
More data for this
Ligand-Target Pair