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BDBM50286819 CHEMBL367463::Pranoprofen::i2-(10H-9-Oxa-1-aza-anthracen-6-yl)-propionic acid

SMILES: CC(C(O)=O)c1ccc2Oc3ncccc3Cc2c1

InChI Key: InChIKey=TVQZAMVBTVNYLA-UHFFFAOYSA-N

Data: 6 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 6 hits for monomerid = 50286819   
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
Prostaglandin G/H synthase 1


(RAT)
BDBM50286819
PNG
(CHEMBL367463 | Pranoprofen | i2-(10H-9-Oxa-1-aza-a...)
Show SMILES CC(C(O)=O)c1ccc2Oc3ncccc3Cc2c1
Show InChI InChI=1S/C15H13NO3/c1-9(15(17)18)10-4-5-13-12(7-10)8-11-3-2-6-16-14(11)19-13/h2-7,9H,8H2,1H3,(H,17,18)
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Article
n/an/a 390n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory activity of the compound against COX-1 from ram seminal vesicles


Bioorg Med Chem Lett 5: 959-962 (1995)


Article DOI: 10.1016/0960-894X(95)00141-F
BindingDB Entry DOI: 10.7270/Q2WM1DDM
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 1


(Ovis aries (Sheep))
BDBM50286819
PNG
(CHEMBL367463 | Pranoprofen | i2-(10H-9-Oxa-1-aza-a...)
Show SMILES CC(C(O)=O)c1ccc2Oc3ncccc3Cc2c1
Show InChI InChI=1S/C15H13NO3/c1-9(15(17)18)10-4-5-13-12(7-10)8-11-3-2-6-16-14(11)19-13/h2-7,9H,8H2,1H3,(H,17,18)
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KEGG

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Article
n/an/a 3.10E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory activity of the compound against COX-1 from ram seminal vesicles


Bioorg Med Chem Lett 5: 959-962 (1995)


Article DOI: 10.1016/0960-894X(95)00141-F
BindingDB Entry DOI: 10.7270/Q2WM1DDM
More data for this
Ligand-Target Pair
ATP-binding cassette sub-family C member 3


(Homo sapiens (Human))
BDBM50286819
PNG
(CHEMBL367463 | Pranoprofen | i2-(10H-9-Oxa-1-aza-a...)
Show SMILES CC(C(O)=O)c1ccc2Oc3ncccc3Cc2c1
Show InChI InChI=1S/C15H13NO3/c1-9(15(17)18)10-4-5-13-12(7-10)8-11-3-2-6-16-14(11)19-13/h2-7,9H,8H2,1H3,(H,17,18)
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n/an/a 1.33E+5n/an/an/an/an/an/a



Amgen Inc

Curated by ChEMBL


Assay Description
Inhibition of human MRP3 overexpressed in Sf9 insect cell membrane vesicles assessed as uptake of [3H]-estradiol-17beta-D-glucuronide in presence of ...


Toxicol Sci 136: 216-41 (2013)


BindingDB Entry DOI: 10.7270/Q2JM2D2D
More data for this
Ligand-Target Pair
ATP-binding cassette sub-family C member 2


(Homo sapiens (Human))
BDBM50286819
PNG
(CHEMBL367463 | Pranoprofen | i2-(10H-9-Oxa-1-aza-a...)
Show SMILES CC(C(O)=O)c1ccc2Oc3ncccc3Cc2c1
Show InChI InChI=1S/C15H13NO3/c1-9(15(17)18)10-4-5-13-12(7-10)8-11-3-2-6-16-14(11)19-13/h2-7,9H,8H2,1H3,(H,17,18)
UniProtKB/SwissProt

antibodypedia
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PubMed
n/an/a 1.33E+5n/an/an/an/an/an/a



Amgen Inc

Curated by ChEMBL


Assay Description
Inhibition of human MRP2 overexpressed in Sf9 cell membrane vesicles assessed as uptake of [3H]-estradiol-17beta-D-glucuronide in presence of ATP and...


Toxicol Sci 136: 216-41 (2013)


BindingDB Entry DOI: 10.7270/Q2JM2D2D
More data for this
Ligand-Target Pair
ATP-binding cassette sub-family C member 4


(Homo sapiens (Human))
BDBM50286819
PNG
(CHEMBL367463 | Pranoprofen | i2-(10H-9-Oxa-1-aza-a...)
Show SMILES CC(C(O)=O)c1ccc2Oc3ncccc3Cc2c1
Show InChI InChI=1S/C15H13NO3/c1-9(15(17)18)10-4-5-13-12(7-10)8-11-3-2-6-16-14(11)19-13/h2-7,9H,8H2,1H3,(H,17,18)
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PubMed
n/an/a 9.80E+3n/an/an/an/an/an/a



Amgen Inc

Curated by ChEMBL


Assay Description
Inhibition of human MRP4 overexpressed in Sf9 cell membrane vesicles assessed as uptake of [3H]-estradiol-17beta-D-glucuronide in presence of ATP and...


Toxicol Sci 136: 216-41 (2013)


BindingDB Entry DOI: 10.7270/Q2JM2D2D
More data for this
Ligand-Target Pair
Bile salt export pump


(Homo sapiens (Human))
BDBM50286819
PNG
(CHEMBL367463 | Pranoprofen | i2-(10H-9-Oxa-1-aza-a...)
Show SMILES CC(C(O)=O)c1ccc2Oc3ncccc3Cc2c1
Show InChI InChI=1S/C15H13NO3/c1-9(15(17)18)10-4-5-13-12(7-10)8-11-3-2-6-16-14(11)19-13/h2-7,9H,8H2,1H3,(H,17,18)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
MCE
PC cid
PC sid
UniChem

Patents


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PubMed
n/an/a 1.33E+5n/an/an/an/an/an/a



Amgen Inc

Curated by ChEMBL


Assay Description
Inhibition of human BSEP overexpressed in Sf9 cell membrane vesicles assessed as uptake of [3H]-taurocholate in presence of ATP measured after 15 to ...


Toxicol Sci 136: 216-41 (2013)


BindingDB Entry DOI: 10.7270/Q2JM2D2D
More data for this
Ligand-Target Pair