BDBM50423877 DIHYDROTANSHINONE::Dihydrotanshinone I::acs.jmedchem.1c00409_ST.562

SMILES: Cc1cccc2c1ccc3c2C(=O)C(=O)C4=C3OC[C@@H]4C

InChI Key: InChIKey=HARGZZNYNSYSGJ-UHFFFAOYSA-N

Data: 10 KI  14 IC50

PDB links: 1 PDB ID matches 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 = 50423877   

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
Replicase polyprotein 1ab (SARS-CoV)	BDBM50423877 (Dihydrotanshinone I | DIHYDROTANSHINONE | acs.jmed...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.44E+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)	BDBM50423877 (Dihydrotanshinone I | DIHYDROTANSHINONE | acs.jmed...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	4.90E+3	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)	BDBM50423877 (Dihydrotanshinone I | DIHYDROTANSHINONE | acs.jmed...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.07E+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)	BDBM50423877 (Dihydrotanshinone I | DIHYDROTANSHINONE | acs.jmed...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Replicase polyprotein 1a (SARS-CoV)	BDBM50423877 (Dihydrotanshinone I | DIHYDROTANSHINONE | acs.jmed...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.44E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Replicase polyprotein 1ab (2019-nCoV)	BDBM50423877 (Dihydrotanshinone I | DIHYDROTANSHINONE | acs.jmed...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	590	n/a	n/a	n/a	n/a	n/a	n/a
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Lysine-specific histone demethylase 1A (Human)	BDBM50423877 (Dihydrotanshinone I | DIHYDROTANSHINONE | acs.jmed...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.59E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Lysine-specific histone demethylase 1A (Human)	BDBM50423877 (Dihydrotanshinone I | DIHYDROTANSHINONE | acs.jmed...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.59E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Acetylcholinesterase (Human)	BDBM50423877 (Dihydrotanshinone I | DIHYDROTANSHINONE | acs.jmed...) 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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Aldo-keto reductase family 1 member B1 (Rat)	BDBM50423877 (Dihydrotanshinone I | DIHYDROTANSHINONE | acs.jmed...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.20E+3	n/a	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)	BDBM50423877 (Dihydrotanshinone I | DIHYDROTANSHINONE | acs.jmed...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.05E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
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Endothelial PAS domain-containing protein 1/Hypoxia-inducible factor 1-alpha (Human)	BDBM50423877 (Dihydrotanshinone I | DIHYDROTANSHINONE | acs.jmed...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.29E+3	n/a	n/a	n/a	n/a	n/a	n/a
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ELAV-like protein 1 (Human)	BDBM50423877 (Dihydrotanshinone I | DIHYDROTANSHINONE | acs.jmed...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	149	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
ELAV-like protein 1 (Human)	BDBM50423877 (Dihydrotanshinone I | DIHYDROTANSHINONE | acs.jmed...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	68	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
ELAV-like protein 1 (Human)	BDBM50423877 (Dihydrotanshinone I | DIHYDROTANSHINONE | acs.jmed...) Show SMILES Show InChI	GoogleScholar	UniChem		50	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Cocaine esterase (Human)	BDBM50423877 (Dihydrotanshinone I | DIHYDROTANSHINONE | acs.jmed...) Show SMILES Show InChI	GoogleScholar	UniChem		118	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Liver carboxylesterase 1 (Human)	BDBM50423877 (Dihydrotanshinone I | DIHYDROTANSHINONE | acs.jmed...) Show SMILES Show InChI	GoogleScholar	UniChem		398	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)	BDBM50423877 (Dihydrotanshinone I | DIHYDROTANSHINONE | acs.jmed...) Show SMILES Show InChI	GoogleScholar	UniChem		600	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)	BDBM50423877 (Dihydrotanshinone I | DIHYDROTANSHINONE | acs.jmed...) Show SMILES Show InChI	GoogleScholar	UniChem		750	-8.35	n/a	n/a	n/a	n/a	n/a	7.0	25
TBA									Citation and Details
					More data for this Ligand-Target Pair
Cocaine esterase (Human)	BDBM50423877 (Dihydrotanshinone I | DIHYDROTANSHINONE | acs.jmed...) Show SMILES Show InChI	GoogleScholar	UniChem		1.83E+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
Acetylcholinesterase (Human)	BDBM50423877 (Dihydrotanshinone I | DIHYDROTANSHINONE | acs.jmed...) Show SMILES Show InChI	GoogleScholar	UniChem		1.95E+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)	BDBM50423877 (Dihydrotanshinone I | DIHYDROTANSHINONE | acs.jmed...) 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
Replicase polyprotein 1ab (SARS-CoV)	BDBM50423877 (Dihydrotanshinone I | DIHYDROTANSHINONE | acs.jmed...) 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)	BDBM50423877 (Dihydrotanshinone I | DIHYDROTANSHINONE | acs.jmed...) 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