BDBM50511112 CHEMBL4567446

SMILES COc1cc(cc(n1)-c1ccc(cc1)C(O)=O)C(=O)N1CCC2(CC1)Cc1cnn(C(C)C)c1C(=O)C2

InChI Key InChIKey=LXZMHBHEXAELHH-UHFFFAOYSA-N

Data  29 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 29 hits for monomerid = 50511112   

TargetAcetyl-CoA carboxylase 1(Homo sapiens (Human))
Terns Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM50511112(CHEMBL4567446)
Affinity DataIC50:  31nMAssay Description:Inhibition of ACC1 (unknown origin)More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetAcetyl-CoA carboxylase 1(Homo sapiens (Human))
Terns Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM50511112(CHEMBL4567446)
Affinity DataIC50:  32nMAssay Description:Inhibition of recombinant human ACC1 using acetyl coA as substrate incubated for 1 hr by transcreener fluorescence polarization assayMore data for this Ligand-Target Pair
In DepthDetails PubMed
TargetBile salt export pump(Homo sapiens (Human))
Pfizer

Curated by ChEMBL
LigandPNGBDBM50511112(CHEMBL4567446)
Affinity DataIC50:  9.40E+4nMAssay Description:Inhibition of human BSEP expressed in baculovirus infected Hi5 insect cells in presence of taurocholic acid by LC-MS/MS analysisMore data for this Ligand-Target Pair
In DepthDetails PubMed
TargetSolute carrier family 22 member 2(Homo sapiens (Human))
Pfizer

Curated by ChEMBL
LigandPNGBDBM50511112(CHEMBL4567446)
Affinity DataIC50: >3.00E+4nMAssay Description:Inhibition of human SLC22A2 expressed in HEK293 cells in presence of para-aminohippuric acid/metforminMore data for this Ligand-Target Pair
In DepthDetails PubMed
TargetSolute carrier family 22 member 8(Homo sapiens (Human))
Pfizer

Curated by ChEMBL
LigandPNGBDBM50511112(CHEMBL4567446)
Affinity DataIC50: >3.00E+4nMAssay Description:Inhibition of human SLC22A8 expressed in HEK293 cells in presence of para-aminohippuric acid/metforminMore data for this Ligand-Target Pair
In DepthDetails PubMed
TargetSolute carrier family 22 member 6(Homo sapiens (Human))
Pfizer

Curated by ChEMBL
LigandPNGBDBM50511112(CHEMBL4567446)
Affinity DataIC50: >3.00E+4nMAssay Description:Inhibition of human SLC22A6 expressed in HEK293 cells in presence of para-aminohippuric acid/metforminMore data for this Ligand-Target Pair
In DepthDetails PubMed
TargetSolute carrier organic anion transporter family member 1B3(Homo sapiens (Human))
Pfizer

Curated by ChEMBL
LigandPNGBDBM50511112(CHEMBL4567446)
Affinity DataIC50:  1.37E+5nMAssay Description:Inhibition of human OATP1B3 expressed in HEK293 cells n presence of rosuvastatinMore data for this Ligand-Target Pair
In DepthDetails PubMed
TargetSolute carrier organic anion transporter family member 1B1(Homo sapiens (Human))
Pfizer

Curated by ChEMBL
LigandPNGBDBM50511112(CHEMBL4567446)
Affinity DataIC50:  1.17E+4nMAssay Description:Inhibition of human OATP1B1 expressed in HEK293 cells n presence of rosuvastatinMore data for this Ligand-Target Pair
In DepthDetails PubMed
LigandPNGBDBM50511112(CHEMBL4567446)
Affinity DataIC50:  6.80E+4nMAssay Description:Inhibition of human ABCG2 expressed in MDCK2-LE cells in presence of digoxinMore data for this Ligand-Target Pair
In DepthDetails PubMed
TargetMultidrug resistance-associated protein 1(Homo sapiens (Human))
Pfizer

Curated by ChEMBL
LigandPNGBDBM50511112(CHEMBL4567446)
Affinity DataIC50:  3.90E+4nMAssay Description:Inhibition of human ABCC1 expressed in MDCK2-LE cells in presence of pitavastatinMore data for this Ligand-Target Pair
In DepthDetails PubMed
TargetUDP-glucuronosyltransferase 2B15(Homo sapiens)
Pfizer

Curated by ChEMBL
LigandPNGBDBM50511112(CHEMBL4567446)
Affinity DataIC50: >2.00E+4nMAssay Description:Inhibition of UGT2B15 in human liver microsomes in presence of UDPGA by LC-MS/MS analysisMore data for this Ligand-Target Pair
In DepthDetails PubMed
TargetUDP-glucuronosyltransferase 2B7(Homo sapiens (Human))
Pfizer

Curated by ChEMBL
LigandPNGBDBM50511112(CHEMBL4567446)
Affinity DataIC50: >2.00E+4nMAssay Description:Inhibition of UGT2B7 in human liver microsomes incubated for 60 mins in presence of UDPGA by LC-MS/MS analysisMore data for this Ligand-Target Pair
In DepthDetails PubMed
TargetUDP-glucuronosyltransferase 1A9(Homo sapiens (Human))
Pfizer

Curated by ChEMBL
LigandPNGBDBM50511112(CHEMBL4567446)
Affinity DataIC50: >2.00E+4nMAssay Description:Inhibition of UGT1A9 in human liver microsomes incubated for 30 mins in presence of UDPGA by LC-MS/MS analysisMore data for this Ligand-Target Pair
In DepthDetails PubMed
TargetUDP-glucuronosyltransferase 1-6(Homo sapiens (Human))
Pfizer

Curated by ChEMBL
LigandPNGBDBM50511112(CHEMBL4567446)
Affinity DataIC50: >2.00E+4nMAssay Description:Inhibition of UGT1A6 in human liver microsomes incubated for 90 mins in presence of UDPGA by LC-MS/MS analysisMore data for this Ligand-Target Pair
In DepthDetails PubMed
TargetCytochrome P450 3A4(Homo sapiens (Human))
Pfizer

Curated by ChEMBL
LigandPNGBDBM50511112(CHEMBL4567446)
Affinity DataIC50: >5.00E+4nMAssay Description:inhibition of CYP3A4 in human liver microsomesMore data for this Ligand-Target Pair
In DepthDetails PubMed
TargetCytochrome P450 2D6(Homo sapiens (Human))
Pfizer

Curated by ChEMBL
LigandPNGBDBM50511112(CHEMBL4567446)
Affinity DataIC50: >5.00E+4nMAssay Description:inhibition of CYP2D6 in human liver microsomesMore data for this Ligand-Target Pair
In DepthDetails PubMed
TargetCytochrome P450 2C19(Homo sapiens (Human))
Pfizer

Curated by ChEMBL
LigandPNGBDBM50511112(CHEMBL4567446)
Affinity DataIC50: >5.00E+4nMAssay Description:inhibition of CYP2C19 in human liver microsomesMore data for this Ligand-Target Pair
In DepthDetails PubMed
TargetCytochrome P450 2C9(Homo sapiens (Human))
Pfizer

Curated by ChEMBL
LigandPNGBDBM50511112(CHEMBL4567446)
Affinity DataIC50: >5.00E+4nMAssay Description:inhibition of CYP2C9 in human liver microsomesMore data for this Ligand-Target Pair
In DepthDetails PubMed
TargetCytochrome P450 2B6(Homo sapiens (Human))
Pfizer

Curated by ChEMBL
LigandPNGBDBM50511112(CHEMBL4567446)
Affinity DataIC50: >5.00E+4nMAssay Description:inhibition of CYP2B6 in human liver microsomesMore data for this Ligand-Target Pair
In DepthDetails PubMed
TargetCytochrome P450 2C8(Homo sapiens (Human))
Pfizer

Curated by ChEMBL
LigandPNGBDBM50511112(CHEMBL4567446)
Affinity DataIC50: >5.00E+4nMAssay Description:inhibition of CYP2C8 in human liver microsomesMore data for this Ligand-Target Pair
In DepthDetails PubMed
TargetCytochrome P450 1A2(Homo sapiens (Human))
Pfizer

Curated by ChEMBL
LigandPNGBDBM50511112(CHEMBL4567446)
Affinity DataIC50: >5.00E+4nMAssay Description:inhibition of CYP1A2 in human liver microsomesMore data for this Ligand-Target Pair
In DepthDetails PubMed
TargetUDP-glucuronosyltransferase 1A4(Homo sapiens (Human))
Pfizer

Curated by ChEMBL
LigandPNGBDBM50511112(CHEMBL4567446)
Affinity DataIC50: >2.00E+4nMAssay Description:Inhibition of UGT1A4 in human liver microsomes incubated for 30 mins in presence of UDPGA by LC-MS/MS analysisMore data for this Ligand-Target Pair
In DepthDetails PubMed
TargetAcetyl-CoA carboxylase 1(Rattus norvegicus (Rat))
Pfizer

Curated by ChEMBL
LigandPNGBDBM50511112(CHEMBL4567446)
Affinity DataIC50:  7.5nMAssay Description:Inhibition of rat ACC1 using acetyl-CoA as substrate incubated for 20 mins in presence of [14C]O3 by liquid scintillation counting methodMore data for this Ligand-Target Pair
In DepthDetails PubMed
TargetAcetyl-CoA carboxylase 2(Homo sapiens (Human))
Pfizer

Curated by ChEMBL
LigandPNGBDBM50511112(CHEMBL4567446)
Affinity DataIC50:  8.70nMAssay Description:Uncompetitive inhibition of human ACC2 incubated for 15 mins in presence of ATP by Line weaver-Burk plot analysisMore data for this Ligand-Target Pair
In DepthDetails PubMed
TargetAcetyl-CoA carboxylase 1(Homo sapiens (Human))
Terns Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM50511112(CHEMBL4567446)
Affinity DataIC50:  12nMAssay Description:Uncompetitive inhibition of human ACC1 incubated for 15 mins in presence of ATP by Line weaver-Burk plot analysisMore data for this Ligand-Target Pair
In DepthDetails PubMed
TargetAcetyl-CoA carboxylase 2(Homo sapiens (Human))
Pfizer

Curated by ChEMBL
LigandPNGBDBM50511112(CHEMBL4567446)
Affinity DataIC50:  26nMAssay Description:Inhibition of recombinant human ACC2 using acetyl coA as substrate incubated for 1 hr by transcreener fluorescence polarization assayMore data for this Ligand-Target Pair
In DepthDetails PubMed
TargetAcetyl-CoA carboxylase 2(Homo sapiens (Human))
Pfizer

Curated by ChEMBL
LigandPNGBDBM50511112(CHEMBL4567446)
Affinity DataIC50:  25nMAssay Description:Inhibition of recombinant human ACC2 using acetyl coA as substrate incubated for 1 hr by transcreener fluorescence polarization assayMore data for this Ligand-Target Pair
In DepthDetails PubMed
TargetAcetyl-CoA carboxylase 1(Homo sapiens (Human))
Terns Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM50511112(CHEMBL4567446)
Affinity DataIC50:  33nMAssay Description:Inhibition of recombinant human ACC1 using acetyl coA as substrate incubated for 1 hr by transcreener fluorescence polarization assayMore data for this Ligand-Target Pair
In DepthDetails PubMed
TargetAcetyl-CoA carboxylase 2(Homo sapiens (Human))
Pfizer

Curated by ChEMBL
LigandPNGBDBM50511112(CHEMBL4567446)
Affinity DataIC50:  30nMAssay Description:Inhibition of ACC2 (unknown origin)More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed