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BDBM50071985 8-fluoro-1,3,3-trimethyl-9-nitro-4,11-dihydro-3H-indeno[2,1-f]quinoline::CHEMBL328804

SMILES: CC1=CC(C)(C)Nc2ccc-3c(Cc4cc(c(F)cc-34)[N+]([O-])=O)c12

InChI Key: InChIKey=OZWYSRUDBXCHMT-UHFFFAOYSA-N

Data: 2 KI  1 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 = 50071985   
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))
BDBM50071985
PNG
(8-fluoro-1,3,3-trimethyl-9-nitro-4,11-dihydro-3H-i...)
Show SMILES CC1=CC(C)(C)Nc2ccc-3c(Cc4cc(c(F)cc-34)[N+]([O-])=O)c12 |t:1|
Show InChI InChI=1S/C19H17FN2O2/c1-10-9-19(2,3)21-16-5-4-12-13-8-15(20)17(22(23)24)7-11(13)6-14(12)18(10)16/h4-5,7-9,21H,6H2,1-3H3
PDB

KEGG

UniProtKB/SwissProt

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

Similars

PubMed
97n/an/an/an/an/an/an/an/a



Ligand Pharmaceuticals

Curated by ChEMBL


Assay Description
Binding affinity against human progesterone receptor-A (hPR-A)


Bioorg Med Chem Lett 8: 2731-6 (1999)


BindingDB Entry DOI: 10.7270/Q2QF8S1M
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50071985
PNG
(8-fluoro-1,3,3-trimethyl-9-nitro-4,11-dihydro-3H-i...)
Show SMILES CC1=CC(C)(C)Nc2ccc-3c(Cc4cc(c(F)cc-34)[N+]([O-])=O)c12 |t:1|
Show InChI InChI=1S/C19H17FN2O2/c1-10-9-19(2,3)21-16-5-4-12-13-8-15(20)17(22(23)24)7-11(13)6-14(12)18(10)16/h4-5,7-9,21H,6H2,1-3H3
PDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
98n/an/an/an/an/an/an/an/a



Scientific Computing Ltd.

Curated by ChEMBL


Assay Description
Displacement of [3H]progesterone from Progesterone receptor


J Med Chem 49: 4261-8 (2006)


Article DOI: 10.1021/jm060234e
BindingDB Entry DOI: 10.7270/Q2V69NB6
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50071985
PNG
(8-fluoro-1,3,3-trimethyl-9-nitro-4,11-dihydro-3H-i...)
Show SMILES CC1=CC(C)(C)Nc2ccc-3c(Cc4cc(c(F)cc-34)[N+]([O-])=O)c12 |t:1|
Show InChI InChI=1S/C19H17FN2O2/c1-10-9-19(2,3)21-16-5-4-12-13-8-15(20)17(22(23)24)7-11(13)6-14(12)18(10)16/h4-5,7-9,21H,6H2,1-3H3
PDB

KEGG

UniProtKB/SwissProt

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

Similars

PubMed
n/an/a 3.33E+3n/an/an/an/an/an/a



Ligand Pharmaceuticals

Curated by ChEMBL


Assay Description
Antagonist activity against human progesterone receptor B (hPR-B) in cotransfected CV-1 cells


Bioorg Med Chem Lett 8: 2731-6 (1999)


BindingDB Entry DOI: 10.7270/Q2QF8S1M
More data for this
Ligand-Target Pair