BDBM50108877 (3,4-Dihydroxy-5-nitro-phenyl)-p-tolyl-methanone::(3,4-dihydroxy-5-nitrophenyl)(p-tolyl)methanone::CHEMBL1324::Ro-40-7592::TOLCAPONE::Talcapone::Tasmar

SMILES: Cc1ccc(cc1)C(=O)c2cc(c(c(c2)O)O)[N+](=O)[O-]

InChI Key: InChIKey=MIQPIUSUKVNLNT-UHFFFAOYSA-N

Data: 30 IC50  9 Kd  1 EC50

PDB links: 10 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 40 hits for monomerid = 50108877   

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
Transthyretin (Human)	BDBM50108877 (CHEMBL1324 | Tasmar | Ro-40-7592 | (3,4-dihydroxy-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	50	n/a	n/a	n/a	n/a	n/a
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Genome polyprotein (DENV-2)	BDBM50108877 (CHEMBL1324 | Tasmar | Ro-40-7592 | (3,4-dihydroxy-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	640	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Genome polyprotein (DENV-2)	BDBM50108877 (CHEMBL1324 | Tasmar | Ro-40-7592 | (3,4-dihydroxy-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	640	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Genome polyprotein (DENV-2)	BDBM50108877 (CHEMBL1324 | Tasmar | Ro-40-7592 | (3,4-dihydroxy-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	640	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Transthyretin (Human)	BDBM50108877 (CHEMBL1324 | Tasmar | Ro-40-7592 | (3,4-dihydroxy-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	34	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Transthyretin (Human)	BDBM50108877 (CHEMBL1324 | Tasmar | Ro-40-7592 | (3,4-dihydroxy-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	34	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Catechol O-methyltransferase (Rat)	BDBM50108877 (CHEMBL1324 | Tasmar | Ro-40-7592 | (3,4-dihydroxy-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Catechol O-methyltransferase (Rat)	BDBM50108877 (CHEMBL1324 | Tasmar | Ro-40-7592 | (3,4-dihydroxy-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	930	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Transthyretin (Human)	BDBM50108877 (CHEMBL1324 | Tasmar | Ro-40-7592 | (3,4-dihydroxy-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	48	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Transthyretin (Human)	BDBM50108877 (CHEMBL1324 | Tasmar | Ro-40-7592 | (3,4-dihydroxy-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	440	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Genome polyprotein (DENV-2)	BDBM50108877 (CHEMBL1324 | Tasmar | Ro-40-7592 | (3,4-dihydroxy-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	640	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Catechol O-methyltransferase (Rat)	BDBM50108877 (CHEMBL1324 | Tasmar | Ro-40-7592 | (3,4-dihydroxy-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	53	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Catechol O-methyltransferase (Rat)	BDBM50108877 (CHEMBL1324 | Tasmar | Ro-40-7592 | (3,4-dihydroxy-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	17	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Catechol O-methyltransferase (Rat)	BDBM50108877 (CHEMBL1324 | Tasmar | Ro-40-7592 | (3,4-dihydroxy-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Krueppel-like factor 10 (Human)	BDBM50108877 (CHEMBL1324 | Tasmar | Ro-40-7592 | (3,4-dihydroxy-...) 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
Bile salt export pump (Rat)	BDBM50108877 (CHEMBL1324 | Tasmar | Ro-40-7592 | (3,4-dihydroxy-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	4.72E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Bile salt export pump (Human)	BDBM50108877 (CHEMBL1324 | Tasmar | Ro-40-7592 | (3,4-dihydroxy-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.20E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Catechol O-methyltransferase (Rat)	BDBM50108877 (CHEMBL1324 | Tasmar | Ro-40-7592 | (3,4-dihydroxy-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.20	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Lanosterol synthase (Rat)	BDBM50108877 (CHEMBL1324 | Tasmar | Ro-40-7592 | (3,4-dihydroxy-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	127	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Bile salt export pump (Human)	BDBM50108877 (CHEMBL1324 | Tasmar | Ro-40-7592 | (3,4-dihydroxy-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	3.45E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Catechol O-methyltransferase (Rat)	BDBM50108877 (CHEMBL1324 | Tasmar | Ro-40-7592 | (3,4-dihydroxy-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	0.910	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
ATP-binding cassette sub-family C member 3 (Human)	BDBM50108877 (CHEMBL1324 | Tasmar | Ro-40-7592 | (3,4-dihydroxy-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	8.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Bile salt export pump (Human)	BDBM50108877 (CHEMBL1324 | Tasmar | Ro-40-7592 | (3,4-dihydroxy-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	3.66E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
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ATP-binding cassette sub-family C member 4 (Human)	BDBM50108877 (CHEMBL1324 | Tasmar | Ro-40-7592 | (3,4-dihydroxy-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.67E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Lanosterol synthase (Rat)	BDBM50108877 (CHEMBL1324 | Tasmar | Ro-40-7592 | (3,4-dihydroxy-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>1	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Transthyretin (Human)	BDBM50108877 (CHEMBL1324 | Tasmar | Ro-40-7592 | (3,4-dihydroxy-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	21	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Transthyretin (Human)	BDBM50108877 (CHEMBL1324 | Tasmar | Ro-40-7592 | (3,4-dihydroxy-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	56	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Genome polyprotein (WNV)	BDBM50108877 (CHEMBL1324 | Tasmar | Ro-40-7592 | (3,4-dihydroxy-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	700	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Genome polyprotein (DENV-2)	BDBM50108877 (CHEMBL1324 | Tasmar | Ro-40-7592 | (3,4-dihydroxy-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	640	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Lanosterol synthase (Rat)	BDBM50108877 (CHEMBL1324 | Tasmar | Ro-40-7592 | (3,4-dihydroxy-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	<1	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Bile salt export pump (Human)	BDBM50108877 (CHEMBL1324 | Tasmar | Ro-40-7592 | (3,4-dihydroxy-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	<3.39E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Catechol O-methyltransferase (Rat)	BDBM50108877 (CHEMBL1324 | Tasmar | Ro-40-7592 | (3,4-dihydroxy-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	31	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Catechol O-methyltransferase (Rat)	BDBM50108877 (CHEMBL1324 | Tasmar | Ro-40-7592 | (3,4-dihydroxy-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	0.912	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Catechol O-methyltransferase (Rat)	BDBM50108877 (CHEMBL1324 | Tasmar | Ro-40-7592 | (3,4-dihydroxy-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	9.27E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Catechol O-methyltransferase (Rat)	BDBM50108877 (CHEMBL1324 | Tasmar | Ro-40-7592 | (3,4-dihydroxy-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.20	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Genome polyprotein (DENV-2)	BDBM50108877 (CHEMBL1324 | Tasmar | Ro-40-7592 | (3,4-dihydroxy-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	7.10E+3	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Transthyretin (Human)	BDBM50108877 (CHEMBL1324 | Tasmar | Ro-40-7592 | (3,4-dihydroxy-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	980	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Transthyretin (Human)	BDBM50108877 (CHEMBL1324 | Tasmar | Ro-40-7592 | (3,4-dihydroxy-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	3.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Transthyretin (Human)	BDBM50108877 (CHEMBL1324 | Tasmar | Ro-40-7592 | (3,4-dihydroxy-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	3.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Transthyretin (Human)	BDBM50108877 (CHEMBL1324 | Tasmar | Ro-40-7592 | (3,4-dihydroxy-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	95	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair