BDBM50241956 (3S,4aR,6aR,6bS,8aR,11R,12S,12aR,14aR,14bR)-4,4,6a,6b,8a,11,12,14b-octamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,14,14a,14b-icosahydropicen-3-ol::CHEMBL455357::US11660306, Example amyrin::alpha-amyrin::urs-12-en-3beta-ol

SMILES C[C@@H]1CC[C@]2(C)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2[C@H]1C

InChI Key InChIKey=FSLPMRQHCOLESF-SFMCKYFRSA-N

Data  2 KI  5 IC50  1 EC50

  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 8 hits for monomerid = 50241956   

TargetTyrosine-protein phosphatase non-receptor type 1 [1-405](Homo sapiens (Human))
Cold Spring Harbor Laboratory

US Patent
LigandPNGBDBM50241956((3S,4aR,6aR,6bS,8aR,11R,12S,12aR,14aR,14bR)-4,4,6a...)
Affinity DataKi:  4.00E+3nMAssay Description:Glucose in tail blood was measured using a glucometer (One-Touch Basic; Lifescan, CA). For glucose tolerance tests (GTTs), mice were fasted for 10 ho...More data for this Ligand-Target Pair
In DepthDetails US Patent
TargetTyrosine-protein phosphatase non-receptor type 1 [1-321](Homo sapiens (Human))
Cold Spring Harbor Laboratory

US Patent
LigandPNGBDBM50241956((3S,4aR,6aR,6bS,8aR,11R,12S,12aR,14aR,14bR)-4,4,6a...)
Affinity DataKi:  6.00E+3nMAssay Description:Glucose in tail blood was measured using a glucometer (One-Touch Basic; Lifescan, CA). For glucose tolerance tests (GTTs), mice were fasted for 10 ho...More data for this Ligand-Target Pair
In DepthDetails US Patent
TargetDNA topoisomerase 1(Homo sapiens (Human))
Stephen F. Austin State University

Curated by ChEMBL
LigandPNGBDBM50241956((3S,4aR,6aR,6bS,8aR,11R,12S,12aR,14aR,14bR)-4,4,6a...)
Affinity DataIC50: >2.50E+5nMAssay Description:Inhibition of human DNA topoisomerase 1-mediated relaxation of supercoiled DNA by gel electrophoresisMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetPolyunsaturated fatty acid 5-lipoxygenase(Homo sapiens (Human))
Osaka University

Curated by ChEMBL
LigandPNGBDBM50241956((3S,4aR,6aR,6bS,8aR,11R,12S,12aR,14aR,14bR)-4,4,6a...)
Affinity DataIC50: >4.00E+4nMAssay Description:Inhibition of human recombinant 5-LOX expressed in insect cells assessed as decrease in production of 5-HPETE and 5-HETE using arachidonic acid as su...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetPolyunsaturated fatty acid 5-lipoxygenase(Homo sapiens (Human))
Osaka University

Curated by ChEMBL
LigandPNGBDBM50241956((3S,4aR,6aR,6bS,8aR,11R,12S,12aR,14aR,14bR)-4,4,6a...)
Affinity DataIC50: >4.00E+4nMAssay Description:Inhibition of human recombinant 5-LOX expressed in insect cells assessed as decrease in production of 5-HPETE and 5-HETE using arachidonic acid as su...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetDNA topoisomerase 2-alpha(Homo sapiens (Human))
Stephen F. Austin State University

Curated by ChEMBL
LigandPNGBDBM50241956((3S,4aR,6aR,6bS,8aR,11R,12S,12aR,14aR,14bR)-4,4,6a...)
Affinity DataIC50: >2.50E+5nMAssay Description:Inhibition of human DNA topoisomerase 2-mediated relaxation of supercoiled DNA by gel electrophoresisMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetG-protein coupled bile acid receptor 1(Homo sapiens (Human))
Universite Louis Pasteur

Curated by ChEMBL
LigandPNGBDBM50241956((3S,4aR,6aR,6bS,8aR,11R,12S,12aR,14aR,14bR)-4,4,6a...)
Affinity DataEC50: >1.00E+4nMAssay Description:Agonist activity at TGR5 expressed in CHO cells by CRE-driven luciferase reporter gene assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetTyrosine-protein phosphatase non-receptor type 1(Homo sapiens (Human))
Fudan University

Curated by ChEMBL
LigandPNGBDBM50241956((3S,4aR,6aR,6bS,8aR,11R,12S,12aR,14aR,14bR)-4,4,6a...)
Affinity DataIC50:  1.93E+4nMAssay Description:Compound is evaluated for the inhibition of porcine plasma Angiotensin I converting enzymeMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed