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BDBM142632 US8937058, A

SMILES: [H][C@@]12C3CC3C3=CC(=O)CC[C@]3(C)C1CC[C@@]1(C)C2C2CC2[C@@]11CCC(=O)C1

InChI Key: InChIKey=ZOQCHOPYQLCJAE-ZORRQXKKSA-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 = 142632   
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))
BDBM142632
PNG
(US8937058, A)
Show SMILES [H][C@@]12C3CC3C3=CC(=O)CC[C@]3(C)C1CC[C@@]1(C)C2C2CC2[C@@]11CCC(=O)C1 |r,t:6|
Show InChI InChI=1S/C25H32O2/c1-23-6-3-13(26)9-19(23)15-10-16(15)21-18(23)5-7-24(2)22(21)17-11-20(17)25(24)8-4-14(27)12-25/h9,15-18,20-22H,3-8,10-12H2,1-2H3/t15?,16?,17?,18?,20?,21-,22?,23-,24+,25+/m1/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 630n/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))
BDBM142632
PNG
(US8937058, A)
Show SMILES [H][C@@]12C3CC3C3=CC(=O)CC[C@]3(C)C1CC[C@@]1(C)C2C2CC2[C@@]11CCC(=O)C1 |r,t:6|
Show InChI InChI=1S/C25H32O2/c1-23-6-3-13(26)9-19(23)15-10-16(15)21-18(23)5-7-24(2)22(21)17-11-20(17)25(24)8-4-14(27)12-25/h9,15-18,20-22H,3-8,10-12H2,1-2H3/t15?,16?,17?,18?,20?,21-,22?,23-,24+,25+/m1/s1
PDB

KEGG

UniProtKB/SwissProt

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

Similars

US Patent
n/an/a 43.3n/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