BDBM83922 1,6,6-trimethyl-8,9-dihydro-7H-naphtho[1,2-g][1]benzofuran-10,11-dione::1,6,6-trimethyl-8,9-dihydro-7H-naphtho[1,2-g]benzofuran-10,11-dione::1,6,6-trimethyl-8,9-dihydro-7H-naphtho[1,2-g]benzofuran-10,11-quinone::MLS001048863::SMR000387068::acs.jmedchem.1c00409_ST.743::cid_164676::med.21724, Compound 173

SMILES: Cc1coc-2c1C(=O)C(=O)c1c3CCCC(C)(C)c3ccc-21

InChI Key: InChIKey=HYXITZLLTYIPOF-UHFFFAOYSA-N

Data: 7 KI  28 IC50  1 Kd

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 36 hits for monomerid = 83922   

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 (Rat)	BDBM83922 (cid_164676 | 1,6,6-trimethyl-8,9-dihydro-7H-naphth...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.14E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Histone-lysine N-methyltransferase EZH2/Polycomb protein EED/Polycomb protein SUZ12 (Human)	BDBM83922 (cid_164676 | 1,6,6-trimethyl-8,9-dihydro-7H-naphth...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.81E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Tyrosine-protein phosphatase non-receptor type 11 (Human)	BDBM83922 (cid_164676 | 1,6,6-trimethyl-8,9-dihydro-7H-naphth...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.59E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Tyrosine-protein phosphatase non-receptor type 6 (Human)	BDBM83922 (cid_164676 | 1,6,6-trimethyl-8,9-dihydro-7H-naphth...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.14E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Telomerase reverse transcriptase (Human)	BDBM83922 (cid_164676 | 1,6,6-trimethyl-8,9-dihydro-7H-naphth...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	500	n/a	n/a	n/a	n/a	n/a	n/a
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Telomerase reverse transcriptase (Human)	BDBM83922 (cid_164676 | 1,6,6-trimethyl-8,9-dihydro-7H-naphth...) 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
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Papain (Papaya)	BDBM83922 (cid_164676 | 1,6,6-trimethyl-8,9-dihydro-7H-naphth...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.22E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
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Replicase polyprotein 1a (SARS-CoV)	BDBM83922 (cid_164676 | 1,6,6-trimethyl-8,9-dihydro-7H-naphth...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	8.91E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
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Replicase polyprotein 1a (SARS-CoV)	BDBM83922 (cid_164676 | 1,6,6-trimethyl-8,9-dihydro-7H-naphth...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.71E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Replicase polyprotein 1a (SARS-CoV)	BDBM83922 (cid_164676 | 1,6,6-trimethyl-8,9-dihydro-7H-naphth...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
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Aldo-keto reductase family 1 member B1 (Rat)	BDBM83922 (cid_164676 | 1,6,6-trimethyl-8,9-dihydro-7H-naphth...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.14E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Aldo-keto reductase family 1 member B1 (Human)	BDBM83922 (cid_164676 | 1,6,6-trimethyl-8,9-dihydro-7H-naphth...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	8.69E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
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Apoptotic protease-activating factor 1 (Human)	BDBM83922 (cid_164676 | 1,6,6-trimethyl-8,9-dihydro-7H-naphth...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	4.82E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Platelet-derived growth factor receptor alpha/beta (Mouse)	BDBM83922 (cid_164676 | 1,6,6-trimethyl-8,9-dihydro-7H-naphth...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.14E+4	n/a	n/a	n/a	n/a	n/a	n/a
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NACHT, LRR and PYD domains-containing protein 3 (Mouse)	BDBM83922 (cid_164676 | 1,6,6-trimethyl-8,9-dihydro-7H-naphth...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	5.15E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Pyruvate kinase PKM (Human)	BDBM83922 (cid_164676 | 1,6,6-trimethyl-8,9-dihydro-7H-naphth...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.92E+6	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Apoptotic protease-activating factor 1 (Human)	BDBM83922 (cid_164676 | 1,6,6-trimethyl-8,9-dihydro-7H-naphth...) 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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Caspase-9 (Human)	BDBM83922 (cid_164676 | 1,6,6-trimethyl-8,9-dihydro-7H-naphth...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.12E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Replicase polyprotein 1a (SARS-CoV)	BDBM83922 (cid_164676 | 1,6,6-trimethyl-8,9-dihydro-7H-naphth...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	800	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Replicase polyprotein 1ab (SARS-CoV)	BDBM83922 (cid_164676 | 1,6,6-trimethyl-8,9-dihydro-7H-naphth...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	8.91E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
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DNA-(apurinic or apyrimidinic site) endonuclease (Human)	BDBM83922 (cid_164676 | 1,6,6-trimethyl-8,9-dihydro-7H-naphth...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	0.880	n/a	n/a	n/a	n/a	n/a
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Endothelial PAS domain-containing protein 1/Hypoxia-inducible factor 1-alpha (Human)	BDBM83922 (cid_164676 | 1,6,6-trimethyl-8,9-dihydro-7H-naphth...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	7.53E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Endothelial PAS domain-containing protein 1/Hypoxia-inducible factor 1-alpha (Human)	BDBM83922 (cid_164676 | 1,6,6-trimethyl-8,9-dihydro-7H-naphth...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	6.18E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Aldo-keto reductase family 1 member B1 (Rat)	BDBM83922 (cid_164676 | 1,6,6-trimethyl-8,9-dihydro-7H-naphth...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.15E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
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Acetylcholinesterase (Human)	BDBM83922 (cid_164676 | 1,6,6-trimethyl-8,9-dihydro-7H-naphth...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>1.40E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
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Pyruvate kinase PKM (Human)	BDBM83922 (cid_164676 | 1,6,6-trimethyl-8,9-dihydro-7H-naphth...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.92E+6	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Replicase polyprotein 1ab (2019-nCoV)	BDBM83922 (cid_164676 | 1,6,6-trimethyl-8,9-dihydro-7H-naphth...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.57E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
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Indoleamine 2,3-dioxygenase 1 (Human)	BDBM83922 (cid_164676 | 1,6,6-trimethyl-8,9-dihydro-7H-naphth...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
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Tryptophan 2,3-dioxygenase (Human)	BDBM83922 (cid_164676 | 1,6,6-trimethyl-8,9-dihydro-7H-naphth...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Cocaine esterase (Human)	BDBM83922 (cid_164676 | 1,6,6-trimethyl-8,9-dihydro-7H-naphth...) Show SMILES Show InChI	GoogleScholar	UniChem		69	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
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Cocaine esterase (Human)	BDBM83922 (cid_164676 | 1,6,6-trimethyl-8,9-dihydro-7H-naphth...) Show SMILES Show InChI	GoogleScholar	UniChem		2.45E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Peroxisome proliferator-activated receptor gamma (Human)	BDBM83922 (cid_164676 | 1,6,6-trimethyl-8,9-dihydro-7H-naphth...) Show SMILES Show InChI	GoogleScholar	UniChem		2.56E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
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Liver carboxylesterase 1 (Human)	BDBM83922 (cid_164676 | 1,6,6-trimethyl-8,9-dihydro-7H-naphth...) Show SMILES Show InChI	GoogleScholar	UniChem		6.89E+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
Replicase polyprotein 1a (SARS-CoV)	BDBM83922 (cid_164676 | 1,6,6-trimethyl-8,9-dihydro-7H-naphth...) Show SMILES Show InChI	GoogleScholar	UniChem		1.12E+4	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
Acetylcholinesterase (Human)	BDBM83922 (cid_164676 | 1,6,6-trimethyl-8,9-dihydro-7H-naphth...) 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
TBA									Citation and Details
					More data for this Ligand-Target Pair
Acetylcholinesterase (Human)	BDBM83922 (cid_164676 | 1,6,6-trimethyl-8,9-dihydro-7H-naphth...) 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
TBA									Citation and Details
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