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BDBM50133138 9-Fluoro-5-[1-(2-isopropyl-phenyl)-meth-(Z)-ylidene]-2,2,4-trimethyl-2,5-dihydro-1H-6-oxa-1-aza-chrysene::CHEMBL132672

SMILES: CC(C)c1ccccc1\C=C1/Oc2ccc(F)cc2-c2ccc3NC(C)(C)C=C(C)c3c12

InChI Key: InChIKey=QXUJGHLIYHYUAH-WGARJPEWSA-N

Data: 1 KI  2 EC50

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 = 50133138   
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
Progesterone receptor


(Homo sapiens (Human))
BDBM50133138
PNG
(9-Fluoro-5-[1-(2-isopropyl-phenyl)-meth-(Z)-yliden...)
Show SMILES CC(C)c1ccccc1\C=C1/Oc2ccc(F)cc2-c2ccc3NC(C)(C)C=C(C)c3c12 |t:29|
Show InChI InChI=1S/C29H28FNO/c1-17(2)21-9-7-6-8-19(21)14-26-28-22(23-15-20(30)10-13-25(23)32-26)11-12-24-27(28)18(3)16-29(4,5)31-24/h6-17,31H,1-5H3/b26-14-
PDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
1.90n/an/an/an/an/an/an/an/a



Ligand Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards human progesterone receptor A isoform using progesterone as radioligand


J Med Chem 46: 4104-12 (2003)


Article DOI: 10.1021/jm020477g
BindingDB Entry DOI: 10.7270/Q2QZ29C6
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50133138
PNG
(9-Fluoro-5-[1-(2-isopropyl-phenyl)-meth-(Z)-yliden...)
Show SMILES CC(C)c1ccccc1\C=C1/Oc2ccc(F)cc2-c2ccc3NC(C)(C)C=C(C)c3c12 |t:29|
Show InChI InChI=1S/C29H28FNO/c1-17(2)21-9-7-6-8-19(21)14-26-28-22(23-15-20(30)10-13-25(23)32-26)11-12-24-27(28)18(3)16-29(4,5)31-24/h6-17,31H,1-5H3/b26-14-
PDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/an/an/a 4n/an/an/an/a



Ligand Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Agonistic activity against human progesterone receptor in CV-1 cells


J Med Chem 46: 4104-12 (2003)


Article DOI: 10.1021/jm020477g
BindingDB Entry DOI: 10.7270/Q2QZ29C6
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50133138
PNG
(9-Fluoro-5-[1-(2-isopropyl-phenyl)-meth-(Z)-yliden...)
Show SMILES CC(C)c1ccccc1\C=C1/Oc2ccc(F)cc2-c2ccc3NC(C)(C)C=C(C)c3c12 |t:29|
Show InChI InChI=1S/C29H28FNO/c1-17(2)21-9-7-6-8-19(21)14-26-28-22(23-15-20(30)10-13-25(23)32-26)11-12-24-27(28)18(3)16-29(4,5)31-24/h6-17,31H,1-5H3/b26-14-
PDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/an/an/a 54n/an/an/an/a



Ligand Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Agonistic activity against human progesterone receptor in T47D breast cancer cells


J Med Chem 46: 4104-12 (2003)


Article DOI: 10.1021/jm020477g
BindingDB Entry DOI: 10.7270/Q2QZ29C6
More data for this
Ligand-Target Pair