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BDBM191959 US9187429, 104::US9187429, 105::US9187429, 106

SMILES: OC1CCCc2c1cncc2-c1ccc(cc1)C(F)(F)F

InChI Key: InChIKey=KBBRBRKYZRGNMV-UHFFFAOYSA-N

Data: 6 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 6 hits for monomerid = 191959   
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
Cytochrome P450 11B1, mitochondrial


(Homo sapiens (Human))
BDBM191959
PNG
(US9187429, 104 | US9187429, 105 | US9187429, 106)
Show SMILES OC1CCCc2c1cncc2-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C16H14F3NO/c17-16(18,19)11-6-4-10(5-7-11)13-8-20-9-14-12(13)2-1-3-15(14)21/h4-9,15,21H,1-3H2
PDB

KEGG

UniProtKB/SwissProt

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

Similars

US Patent
n/an/an/an/a 710n/an/an/an/a



HOFFMANN-LA ROCHE INC.

US Patent


Assay Description
G-402 cells can be obtained from ATCC(CRL-1440) and were originally derived from a renal leiomyoblastoma. The expression plasmids contains the ORF ...


US Patent US9187429 (2015)


BindingDB Entry DOI: 10.7270/Q2668C04
More data for this
Ligand-Target Pair
Cytochrome P450 11B1, mitochondrial


(Homo sapiens (Human))
BDBM191959
PNG
(US9187429, 104 | US9187429, 105 | US9187429, 106)
Show SMILES OC1CCCc2c1cncc2-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C16H14F3NO/c17-16(18,19)11-6-4-10(5-7-11)13-8-20-9-14-12(13)2-1-3-15(14)21/h4-9,15,21H,1-3H2
PDB

KEGG

UniProtKB/SwissProt

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

Similars

US Patent
n/an/an/an/a 1.67E+3n/an/an/an/a



HOFFMANN-LA ROCHE INC.

US Patent


Assay Description
G-402 cells can be obtained from ATCC(CRL-1440) and were originally derived from a renal leiomyoblastoma. The expression plasmids contains the ORF ...


US Patent US9187429 (2015)


BindingDB Entry DOI: 10.7270/Q2668C04
More data for this
Ligand-Target Pair
Cytochrome P450 11B2 (CYP11B2)


(Homo sapiens (Human))
BDBM191959
PNG
(US9187429, 104 | US9187429, 105 | US9187429, 106)
Show SMILES OC1CCCc2c1cncc2-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C16H14F3NO/c17-16(18,19)11-6-4-10(5-7-11)13-8-20-9-14-12(13)2-1-3-15(14)21/h4-9,15,21H,1-3H2
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/an/an/a 4.60n/an/an/an/a



HOFFMANN-LA ROCHE INC.

US Patent


Assay Description
G-402 cells can be obtained from ATCC(CRL-1440) and were originally derived from a renal leiomyoblastoma. The expression plasmids contains the ORF ...


US Patent US9187429 (2015)


BindingDB Entry DOI: 10.7270/Q2668C04
More data for this
Ligand-Target Pair
Cytochrome P450 11B2 (CYP11B2)


(Homo sapiens (Human))
BDBM191959
PNG
(US9187429, 104 | US9187429, 105 | US9187429, 106)
Show SMILES OC1CCCc2c1cncc2-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C16H14F3NO/c17-16(18,19)11-6-4-10(5-7-11)13-8-20-9-14-12(13)2-1-3-15(14)21/h4-9,15,21H,1-3H2
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/an/an/a 14.6n/an/an/an/a



HOFFMANN-LA ROCHE INC.

US Patent


Assay Description
G-402 cells can be obtained from ATCC(CRL-1440) and were originally derived from a renal leiomyoblastoma. The expression plasmids contains the ORF ...


US Patent US9187429 (2015)


BindingDB Entry DOI: 10.7270/Q2668C04
More data for this
Ligand-Target Pair
Cytochrome P450 11B2 (CYP11B2)


(Homo sapiens (Human))
BDBM191959
PNG
(US9187429, 104 | US9187429, 105 | US9187429, 106)
Show SMILES OC1CCCc2c1cncc2-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C16H14F3NO/c17-16(18,19)11-6-4-10(5-7-11)13-8-20-9-14-12(13)2-1-3-15(14)21/h4-9,15,21H,1-3H2
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/an/an/a 107n/an/an/an/a



HOFFMANN-LA ROCHE INC.

US Patent


Assay Description
G-402 cells can be obtained from ATCC(CRL-1440) and were originally derived from a renal leiomyoblastoma. The expression plasmids contains the ORF ...


US Patent US9187429 (2015)


BindingDB Entry DOI: 10.7270/Q2668C04
More data for this
Ligand-Target Pair
Cytochrome P450 11B1, mitochondrial


(Homo sapiens (Human))
BDBM191959
PNG
(US9187429, 104 | US9187429, 105 | US9187429, 106)
Show SMILES OC1CCCc2c1cncc2-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C16H14F3NO/c17-16(18,19)11-6-4-10(5-7-11)13-8-20-9-14-12(13)2-1-3-15(14)21/h4-9,15,21H,1-3H2
PDB

KEGG

UniProtKB/SwissProt

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

Similars

US Patent
n/an/an/an/a 159n/an/an/an/a



HOFFMANN-LA ROCHE INC.

US Patent


Assay Description
G-402 cells can be obtained from ATCC(CRL-1440) and were originally derived from a renal leiomyoblastoma. The expression plasmids contains the ORF ...


US Patent US9187429 (2015)


BindingDB Entry DOI: 10.7270/Q2668C04
More data for this
Ligand-Target Pair