BDBM50022178 4-Methyl-7-hydroxycoumarin::4-methylumbelliferone::7-Hydroxy-4-methyl-2-oxo-2H-1-benzopyran::7-Hydroxy-4-methyl-2-oxo-3-chromene::7-Hydroxy-4-methyl-2H-1-benzopyran-2-one::7-Hydroxy-4-methyl-2H-2-one (1)::7-Hydroxy-4-methylcoumarin::7-hydroxy-4-methyl-2H-chromen-2-one::CHEMBL12208::Coumarin derivative, 3b::Imecromone::beta-Methylumbelliferone::cid_5280567

SMILES: CC1=CC(=O)Oc2c1ccc(c2)O

InChI Key: InChIKey=HSHNITRMYYLLCV-UHFFFAOYSA-N

Data: 9 KI  15 IC50

PDB links: 7 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 24 hits for monomerid = 50022178   

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
Aldo-keto reductase family 1 member B1 (Human)	BDBM50022178 (4-Methyl-7-hydroxycoumarin | 7-Hydroxy-4-methyl-2H...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.45E+4	n/a	n/a	n/a	n/a	n/a	n/a
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UDP-glucuronosyltransferase 1A1 (Human)	BDBM50022178 (4-Methyl-7-hydroxycoumarin | 7-Hydroxy-4-methyl-2H...) 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
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UDP-glucuronosyltransferase 1A1 (Human)	BDBM50022178 (4-Methyl-7-hydroxycoumarin | 7-Hydroxy-4-methyl-2H...) 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
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Acetylcholinesterase (Electric eel)	BDBM50022178 (4-Methyl-7-hydroxycoumarin | 7-Hydroxy-4-methyl-2H...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.67E+5	n/a	n/a	n/a	n/a	n/a	n/a
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Cholinesterase (Horse)	BDBM50022178 (4-Methyl-7-hydroxycoumarin | 7-Hydroxy-4-methyl-2H...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>5.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
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Aldo-keto reductase family 1 member B1 (Rat)	BDBM50022178 (4-Methyl-7-hydroxycoumarin | 7-Hydroxy-4-methyl-2H...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	6.20E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Nuclear factor NF-kappa-B p105 subunit (Human)	BDBM50022178 (4-Methyl-7-hydroxycoumarin | 7-Hydroxy-4-methyl-2H...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
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Sorbitol dehydrogenase (Human)	BDBM50022178 (4-Methyl-7-hydroxycoumarin | 7-Hydroxy-4-methyl-2H...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.53E+5	n/a	n/a	n/a	n/a	n/a	n/a
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dTDP-4-dehydrorhamnose 3,5-epimerase (Mycobacterium tuberculosis (strain CDC 1551 / Oshk...)	BDBM50022178 (4-Methyl-7-hydroxycoumarin | 7-Hydroxy-4-methyl-2H...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	999	n/a	n/a	n/a	n/a	n/a	n/a
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17-beta-hydroxysteroid dehydrogenase type 3 (Human)	BDBM50022178 (4-Methyl-7-hydroxycoumarin | 7-Hydroxy-4-methyl-2H...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Amine oxidase [flavin-containing] B (Human)	BDBM50022178 (4-Methyl-7-hydroxycoumarin | 7-Hydroxy-4-methyl-2H...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	8.04E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Induced myeloid leukemia cell differentiation protein Mcl-1 (Human)	BDBM50022178 (4-Methyl-7-hydroxycoumarin | 7-Hydroxy-4-methyl-2H...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.04E+5	n/a	n/a	n/a	n/a	n/a	n/a
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Acetylcholinesterase (Electric eel)	BDBM50022178 (4-Methyl-7-hydroxycoumarin | 7-Hydroxy-4-methyl-2H...) 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
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Cholinesterase (Horse)	BDBM50022178 (4-Methyl-7-hydroxycoumarin | 7-Hydroxy-4-methyl-2H...) 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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Genome polyprotein (HCV)	BDBM50022178 (4-Methyl-7-hydroxycoumarin | 7-Hydroxy-4-methyl-2H...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	3.38E+4	n/a	n/a	n/a	n/a	7.0	30
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Carbonic anhydrase 9 (Human)	BDBM50022178 (4-Methyl-7-hydroxycoumarin | 7-Hydroxy-4-methyl-2H...) Show SMILES Show InChI	GoogleScholar	UniChem		450	-8.04	n/a	n/a	n/a	n/a	n/a	7.5	4
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Carbonic anhydrase 9 (Human)	BDBM50022178 (4-Methyl-7-hydroxycoumarin | 7-Hydroxy-4-methyl-2H...) Show SMILES Show InChI	GoogleScholar	UniChem		560	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Carbonic anhydrase 12 (Human)	BDBM50022178 (4-Methyl-7-hydroxycoumarin | 7-Hydroxy-4-methyl-2H...) Show SMILES Show InChI	GoogleScholar	UniChem		4.30E+3	-6.80	n/a	n/a	n/a	n/a	n/a	7.5	4
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Carbonic anhydrase 1 (Human)	BDBM50022178 (4-Methyl-7-hydroxycoumarin | 7-Hydroxy-4-methyl-2H...) Show SMILES Show InChI	GoogleScholar	UniChem		4.80E+3	-6.74	n/a	n/a	n/a	n/a	n/a	7.5	4
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Carbonic anhydrase 12 (Human)	BDBM50022178 (4-Methyl-7-hydroxycoumarin | 7-Hydroxy-4-methyl-2H...) Show SMILES Show InChI	GoogleScholar	UniChem		8.10E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Induced myeloid leukemia cell differentiation protein Mcl-1 (Human)	BDBM50022178 (4-Methyl-7-hydroxycoumarin | 7-Hydroxy-4-methyl-2H...) Show SMILES Show InChI	GoogleScholar	UniChem		2.22E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Carbonic anhydrase 1 (Human)	BDBM50022178 (4-Methyl-7-hydroxycoumarin | 7-Hydroxy-4-methyl-2H...) Show SMILES Show InChI	GoogleScholar	UniChem		>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Carbonic anhydrase 2 (Human)	BDBM50022178 (4-Methyl-7-hydroxycoumarin | 7-Hydroxy-4-methyl-2H...) Show SMILES Show InChI	GoogleScholar	UniChem		>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Carbonic anhydrase 2 (Human)	BDBM50022178 (4-Methyl-7-hydroxycoumarin | 7-Hydroxy-4-methyl-2H...) Show SMILES Show InChI	GoogleScholar	UniChem		>2.00E+5	>-4.69	n/a	n/a	n/a	n/a	n/a	7.5	4
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