BDBM50148911 (3beta)-3-hydroxyurs-12-en-28-oic acid::3beta-hydroxyurs-12-en-28-oic acid::CHEMBL169::Ursolic acid::malol::prunol::urson

SMILES: C[C@@H]1CC[C@@]2(CC[C@@]3(C(=CC[C@H]4[C@]3(CC[C@@H]5[C@@]4(CC[C@@H](C5(C)C)O)C)C)[C@@H]2[C@H]1C)C)C(=O)O

InChI Key: InChIKey=WCGUUGGRBIKTOS-UHFFFAOYSA-N

Data: 3 KI  109 IC50  2 Kd  5 EC50

PDB links: 2 PDB IDs match this monomer.

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 120 hits for monomerid = 50148911   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Tyrosine-protein phosphatase non-receptor type 1 (Human)	BDBM50148911 (3beta-hydroxyurs-12-en-28-oic acid | (3beta)-3-hyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	4.50E+3	n/a	n/a	n/a	n/a	6.0	37
TBA									Citation and Details
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Tyrosine-protein phosphatase non-receptor type 1 (Human)	BDBM50148911 (3beta-hydroxyurs-12-en-28-oic acid | (3beta)-3-hyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	9.43E+3	n/a	n/a	n/a	n/a	6.0	n/a
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Neutrophil elastase (Human)	BDBM50148911 (3beta-hydroxyurs-12-en-28-oic acid | (3beta)-3-hyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	416	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 1 (Human)	BDBM50148911 (3beta-hydroxyurs-12-en-28-oic acid | (3beta)-3-hyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	5.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 1 (Human)	BDBM50148911 (3beta-hydroxyurs-12-en-28-oic acid | (3beta)-3-hyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	5.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 1 (Human)	BDBM50148911 (3beta-hydroxyurs-12-en-28-oic acid | (3beta)-3-hyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	4.12E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 1 (Human)	BDBM50148911 (3beta-hydroxyurs-12-en-28-oic acid | (3beta)-3-hyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.55E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 1 (Human)	BDBM50148911 (3beta-hydroxyurs-12-en-28-oic acid | (3beta)-3-hyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	5.46E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Pancreatic alpha-amylase (Pig)	BDBM50148911 (3beta-hydroxyurs-12-en-28-oic acid | (3beta)-3-hyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.26E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Ubiquitin carboxyl-terminal hydrolase 47 (Human)	BDBM50148911 (3beta-hydroxyurs-12-en-28-oic acid | (3beta)-3-hyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.60E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Ubiquitin carboxyl-terminal hydrolase 7 (Human)	BDBM50148911 (3beta-hydroxyurs-12-en-28-oic acid | (3beta)-3-hyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	7.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Cholesteryl ester transfer protein (Human)	BDBM50148911 (3beta-hydroxyurs-12-en-28-oic acid | (3beta)-3-hyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	4.66E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 1 (Human)	BDBM50148911 (3beta-hydroxyurs-12-en-28-oic acid | (3beta)-3-hyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.55E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 1 (Human)	BDBM50148911 (3beta-hydroxyurs-12-en-28-oic acid | (3beta)-3-hyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	3.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 1 (Human)	BDBM50148911 (3beta-hydroxyurs-12-en-28-oic acid | (3beta)-3-hyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.22E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Transcription factor p65 (Human)	BDBM50148911 (3beta-hydroxyurs-12-en-28-oic acid | (3beta)-3-hyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	31	n/a	n/a	n/a	n/a	n/a	n/a
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Protease (Human immunodeficiency virus type 1)	BDBM50148911 (3beta-hydroxyurs-12-en-28-oic acid | (3beta)-3-hyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	8.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Protease (Human immunodeficiency virus type 1)	BDBM50148911 (3beta-hydroxyurs-12-en-28-oic acid | (3beta)-3-hyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	4.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Protease (Human immunodeficiency virus type 1)	BDBM50148911 (3beta-hydroxyurs-12-en-28-oic acid | (3beta)-3-hyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	6.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Lysosomal alpha-glucosidase (Human)	BDBM50148911 (3beta-hydroxyurs-12-en-28-oic acid | (3beta)-3-hyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	9.67E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 1 (Human)	BDBM50148911 (3beta-hydroxyurs-12-en-28-oic acid | (3beta)-3-hyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	3.08E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 1 (Human)	BDBM50148911 (3beta-hydroxyurs-12-en-28-oic acid | (3beta)-3-hyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	3.08E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
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Cathepsin D (Human)	BDBM50148911 (3beta-hydroxyurs-12-en-28-oic acid | (3beta)-3-hyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.82E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
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DNA ligase 1 (Human)	BDBM50148911 (3beta-hydroxyurs-12-en-28-oic acid | (3beta)-3-hyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.62E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
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Hypoxia-inducible factor 1-alpha (Human)	BDBM50148911 (3beta-hydroxyurs-12-en-28-oic acid | (3beta)-3-hyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Hypoxia-inducible factor 1-alpha (Human)	BDBM50148911 (3beta-hydroxyurs-12-en-28-oic acid | (3beta)-3-hyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
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Egl nine homolog 1/Prolyl hydroxylase EGLN2/Prolyl hydroxylase EGLN3/Transmembrane prolyl 4-hydroxylase (Human)	BDBM50148911 (3beta-hydroxyurs-12-en-28-oic acid | (3beta)-3-hyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	>5.00E+4	n/a	n/a	n/a	n/a
TBA									Citation and Details
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Egl nine homolog 1/Prolyl hydroxylase EGLN2/Prolyl hydroxylase EGLN3/Transmembrane prolyl 4-hydroxylase (Human)	BDBM50148911 (3beta-hydroxyurs-12-en-28-oic acid | (3beta)-3-hyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	>5.00E+4	n/a	n/a	n/a	n/a
TBA									Citation and Details
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Hemagglutinin (Influenza A virus (strain A/Puerto Rico/8/1934 H1N...)	BDBM50148911 (3beta-hydroxyurs-12-en-28-oic acid | (3beta)-3-hyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	4.65E+4	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Hemagglutinin (Influenza A virus (strain A/Puerto Rico/8/1934 H1N...)	BDBM50148911 (3beta-hydroxyurs-12-en-28-oic acid | (3beta)-3-hyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	4.65E+4	n/a	n/a	n/a	n/a	n/a
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Polyunsaturated fatty acid 5-lipoxygenase (Human)	BDBM50148911 (3beta-hydroxyurs-12-en-28-oic acid | (3beta)-3-hyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>4.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
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Prostaglandin G/H synthase 1 (Sheep)	BDBM50148911 (3beta-hydroxyurs-12-en-28-oic acid | (3beta)-3-hyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>4.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
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Prostaglandin G/H synthase 2 (Human)	BDBM50148911 (3beta-hydroxyurs-12-en-28-oic acid | (3beta)-3-hyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>4.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Polyunsaturated fatty acid lipoxygenase ALOX15B (Human)	BDBM50148911 (3beta-hydroxyurs-12-en-28-oic acid | (3beta)-3-hyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>4.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Human)	BDBM50148911 (3beta-hydroxyurs-12-en-28-oic acid | (3beta)-3-hyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>4.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 1 (Sheep)	BDBM50148911 (3beta-hydroxyurs-12-en-28-oic acid | (3beta)-3-hyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>4.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 2 (Human)	BDBM50148911 (3beta-hydroxyurs-12-en-28-oic acid | (3beta)-3-hyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>4.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid lipoxygenase ALOX15B (Human)	BDBM50148911 (3beta-hydroxyurs-12-en-28-oic acid | (3beta)-3-hyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>4.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 1 (Human)	BDBM50148911 (3beta-hydroxyurs-12-en-28-oic acid | (3beta)-3-hyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	3.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 1 (Human)	BDBM50148911 (3beta-hydroxyurs-12-en-28-oic acid | (3beta)-3-hyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Cholesteryl ester transfer protein (Human)	BDBM50148911 (3beta-hydroxyurs-12-en-28-oic acid | (3beta)-3-hyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 1 (Human)	BDBM50148911 (3beta-hydroxyurs-12-en-28-oic acid | (3beta)-3-hyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	5.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 1 (Human)	BDBM50148911 (3beta-hydroxyurs-12-en-28-oic acid | (3beta)-3-hyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.78E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 1 (Human)	BDBM50148911 (3beta-hydroxyurs-12-en-28-oic acid | (3beta)-3-hyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	3.31E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Liver carboxylesterase 1 (Human)	BDBM50148911 (3beta-hydroxyurs-12-en-28-oic acid | (3beta)-3-hyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	100	n/a	n/a	n/a	n/a	n/a	n/a
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Sentrin-specific protease 1 (Human)	BDBM50148911 (3beta-hydroxyurs-12-en-28-oic acid | (3beta)-3-hyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	6.40	n/a	n/a	n/a	n/a	n/a	n/a
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Acidic phospholipase A2 EC-I (Saw-scaled viper)	BDBM50148911 (3beta-hydroxyurs-12-en-28-oic acid | (3beta)-3-hyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Basic phospholipase A2 1 (Forest cobra)	BDBM50148911 (3beta-hydroxyurs-12-en-28-oic acid | (3beta)-3-hyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Basic phospholipase A2 PLA-A (Habu)	BDBM50148911 (3beta-hydroxyurs-12-en-28-oic acid | (3beta)-3-hyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Sentrin-specific protease 1 (Human)	BDBM50148911 (3beta-hydroxyurs-12-en-28-oic acid | (3beta)-3-hyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.58E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
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