BDBM54263 (4aS,6aR,6aR,6bR,8aR,12aR,14aS)-10-keto-2,2,6a,6b,9,9,12a-heptamethyl-4,5,6,6a,7,8,8a,11,12,13,14,14a-dodecahydro-3H-picene-4a-carboxylic acid::(4aS,6aR,6aR,6bR,8aR,12aR,14aS)-2,2,6a,6b,9,9,12a-heptamethyl-10-oxidanylidene-4,5,6,6a,7,8,8a,11,12,13,14,14a-dodecahydro-3H-picene-4a-carboxylic acid::(4aS,6aR,6aR,6bR,8aR,12aR,14aS)-2,2,6a,6b,9,9,12a-heptamethyl-10-oxo-4,5,6,6a,7,8,8a,11,12,13,14,14a-dodecahydro-3H-picene-4a-carboxylic acid::MLS000563430::MORONIC ACID::SMR000232278::US11660306, Example Moronic acid::cid_489941

SMILES: CC1(C)CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CCC(=O)C(C)(C)[C@@H]5CC[C@@]34C)C2=C1)C(O)=O

InChI Key: InChIKey=UMYJVVZWBKIXQQ-UHFFFAOYSA-N

Data: 3 KI  7 IC50  1 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 11 hits for monomerid = 54263   

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
Nucleotide-binding oligomerization domain-containing protein 2 (Human)	BDBM54263 (cid_489941 | MORONIC ACID | SMR000232278 | MLS0005...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	8.08E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Nucleotide-binding oligomerization domain-containing protein 1 (Human)	BDBM54263 (cid_489941 | MORONIC ACID | SMR000232278 | MLS0005...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	2.27E+3	n/a	n/a	n/a	n/a
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Tumor necrosis factor (Human)	BDBM54263 (cid_489941 | MORONIC ACID | SMR000232278 | MLS0005...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.09E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Tyrosine-protein phosphatase non-receptor type 1 (Human)	BDBM54263 (cid_489941 | MORONIC ACID | SMR000232278 | MLS0005...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.32E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Receptor-type tyrosine-protein phosphatase F (Human)	BDBM54263 (cid_489941 | MORONIC ACID | SMR000232278 | MLS0005...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	4.56E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Low molecular weight phosphotyrosine protein phosphatase (Human)	BDBM54263 (cid_489941 | MORONIC ACID | SMR000232278 | MLS0005...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.06E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Low molecular weight phosphotyrosine protein phosphatase (Human)	BDBM54263 (cid_489941 | MORONIC ACID | SMR000232278 | MLS0005...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.74E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Tyrosine-protein phosphatase non-receptor type 1 (Human)	BDBM54263 (cid_489941 | MORONIC ACID | SMR000232278 | MLS0005...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.32E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Tyrosine-protein phosphatase non-receptor type 1 [1-405] (Human)	BDBM54263 (cid_489941 | MORONIC ACID | SMR000232278 | MLS0005...) Show SMILES Show InChI	GoogleScholar	UniChem		5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Tyrosine-protein phosphatase non-receptor type 1 [1-321] (Human)	BDBM54263 (cid_489941 | MORONIC ACID | SMR000232278 | MLS0005...) Show SMILES Show InChI	GoogleScholar	UniChem		7.00E+3	n/a	n/a	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)	BDBM54263 (cid_489941 | MORONIC ACID | SMR000232278 | MLS0005...) Show SMILES Show InChI	GoogleScholar	UniChem		8.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair