BDBM9019 CHEMBL45::Melatonin::N-[2-(5-methoxy-1H-indol-3-yl)ethyl]acetamide

SMILES: CC(=O)NCCc1c[nH]c2c1cc(cc2)OC

InChI Key: InChIKey=DRLFMBDRBRZALE-UHFFFAOYSA-N

Data: 176 KI  33 IC50  1 Kd  23 EC50  1 ITC

PDB links: 9 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 233 hits for monomerid = 9019   

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
Acetylcholinesterase (Bovine)	BDBM9019 (CHEMBL45 | N-[2-(5-methoxy-1H-indol-3-yl)ethyl]ace...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>100	n/a	n/a	n/a	n/a	8.0	30
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Carboxylic ester hydrolase (Horse)	BDBM9019 (CHEMBL45 | N-[2-(5-methoxy-1H-indol-3-yl)ethyl]ace...) 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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Ribosyldihydronicotinamide dehydrogenase [quinone] (Human)	BDBM9019 (CHEMBL45 | N-[2-(5-methoxy-1H-indol-3-yl)ethyl]ace...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.13E+4	n/a	n/a	n/a	n/a	7.5	23
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					More data for this Ligand-Target Pair
Ribosyldihydronicotinamide dehydrogenase [quinone] (Human)	BDBM9019 (CHEMBL45 | N-[2-(5-methoxy-1H-indol-3-yl)ethyl]ace...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.13E+4	n/a	n/a	n/a	n/a	8.0	25
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Bile salt export pump (Human)	BDBM9019 (CHEMBL45 | N-[2-(5-methoxy-1H-indol-3-yl)ethyl]ace...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>1.33E+5	n/a	n/a	n/a	n/a	n/a	n/a
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ATP-binding cassette sub-family C member 4 (Human)	BDBM9019 (CHEMBL45 | N-[2-(5-methoxy-1H-indol-3-yl)ethyl]ace...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>1.33E+5	n/a	n/a	n/a	n/a	n/a	n/a
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ATP-binding cassette sub-family C member 3 (Human)	BDBM9019 (CHEMBL45 | N-[2-(5-methoxy-1H-indol-3-yl)ethyl]ace...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>1.33E+5	n/a	n/a	n/a	n/a	n/a	n/a
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ATP-binding cassette sub-family C member 2 (Human)	BDBM9019 (CHEMBL45 | N-[2-(5-methoxy-1H-indol-3-yl)ethyl]ace...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>1.33E+5	n/a	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Ribosyldihydronicotinamide dehydrogenase [quinone] (Human)	BDBM9019 (CHEMBL45 | N-[2-(5-methoxy-1H-indol-3-yl)ethyl]ace...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	6.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Melatonin receptor type 1A/1B (Human)	BDBM9019 (CHEMBL45 | N-[2-(5-methoxy-1H-indol-3-yl)ethyl]ace...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	0.0915	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Melatonin receptor type 1A/1B (Human)	BDBM9019 (CHEMBL45 | N-[2-(5-methoxy-1H-indol-3-yl)ethyl]ace...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	0.157	n/a	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Melatonin receptor type 1A/1B (Human)	BDBM9019 (CHEMBL45 | N-[2-(5-methoxy-1H-indol-3-yl)ethyl]ace...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	3.10	n/a	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Melatonin receptor type 1A/1B (Human)	BDBM9019 (CHEMBL45 | N-[2-(5-methoxy-1H-indol-3-yl)ethyl]ace...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.20	n/a	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Melatonin receptor type 1A/1B (Human)	BDBM9019 (CHEMBL45 | N-[2-(5-methoxy-1H-indol-3-yl)ethyl]ace...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	15	n/a	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Melatonin receptor type 1A/1B (Human)	BDBM9019 (CHEMBL45 | N-[2-(5-methoxy-1H-indol-3-yl)ethyl]ace...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.20	n/a	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Melatonin receptor type 1A/1B (Human)	BDBM9019 (CHEMBL45 | N-[2-(5-methoxy-1H-indol-3-yl)ethyl]ace...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	3	n/a	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Melatonin receptor type 1A/1B (Human)	BDBM9019 (CHEMBL45 | N-[2-(5-methoxy-1H-indol-3-yl)ethyl]ace...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	13	n/a	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Melatonin receptor type 1A/1B (Human)	BDBM9019 (CHEMBL45 | N-[2-(5-methoxy-1H-indol-3-yl)ethyl]ace...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.20	n/a	n/a	n/a	n/a	n/a	n/a
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Melatonin receptor type 1C (Chicken)	BDBM9019 (CHEMBL45 | N-[2-(5-methoxy-1H-indol-3-yl)ethyl]ace...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	23	n/a	n/a	n/a	n/a
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Melatonin receptor type 1C (African clawed frog)	BDBM9019 (CHEMBL45 | N-[2-(5-methoxy-1H-indol-3-yl)ethyl]ace...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	0.0794	n/a	n/a	n/a	n/a
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Myeloperoxidase (Human)	BDBM9019 (CHEMBL45 | N-[2-(5-methoxy-1H-indol-3-yl)ethyl]ace...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	3.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Melatonin receptor type 1A (Human)	BDBM9019 (CHEMBL45 | N-[2-(5-methoxy-1H-indol-3-yl)ethyl]ace...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	1	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Melatonin receptor type 1B (Human)	BDBM9019 (CHEMBL45 | N-[2-(5-methoxy-1H-indol-3-yl)ethyl]ace...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	25	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Melatonin receptor type 1B (Human)	BDBM9019 (CHEMBL45 | N-[2-(5-methoxy-1H-indol-3-yl)ethyl]ace...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	0.470	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Melatonin receptor type 1A (Human)	BDBM9019 (CHEMBL45 | N-[2-(5-methoxy-1H-indol-3-yl)ethyl]ace...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	1.92	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Melatonin receptor type 1B (Human)	BDBM9019 (CHEMBL45 | N-[2-(5-methoxy-1H-indol-3-yl)ethyl]ace...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	0.300	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Melatonin receptor type 1A (Human)	BDBM9019 (CHEMBL45 | N-[2-(5-methoxy-1H-indol-3-yl)ethyl]ace...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	0.600	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Melatonin receptor type 1A (Human)	BDBM9019 (CHEMBL45 | N-[2-(5-methoxy-1H-indol-3-yl)ethyl]ace...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	2.24	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Melatonin receptor type 1B (Human)	BDBM9019 (CHEMBL45 | N-[2-(5-methoxy-1H-indol-3-yl)ethyl]ace...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	0.490	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Melatonin receptor type 1B (Human)	BDBM9019 (CHEMBL45 | N-[2-(5-methoxy-1H-indol-3-yl)ethyl]ace...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	0.0700	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Melatonin receptor type 1A (Human)	BDBM9019 (CHEMBL45 | N-[2-(5-methoxy-1H-indol-3-yl)ethyl]ace...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	0.110	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Melatonin receptor type 1A (Human)	BDBM9019 (CHEMBL45 | N-[2-(5-methoxy-1H-indol-3-yl)ethyl]ace...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	0.0220	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Melatonin receptor type 1B (Human)	BDBM9019 (CHEMBL45 | N-[2-(5-methoxy-1H-indol-3-yl)ethyl]ace...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	0.850	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Melatonin receptor type 1A (Human)	BDBM9019 (CHEMBL45 | N-[2-(5-methoxy-1H-indol-3-yl)ethyl]ace...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	0.0692	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Melatonin receptor type 1B (Human)	BDBM9019 (CHEMBL45 | N-[2-(5-methoxy-1H-indol-3-yl)ethyl]ace...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	0.174	n/a	n/a	n/a	n/a
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Palmitoleoyl-protein carboxylesterase NOTUM (Human)	BDBM9019 (CHEMBL45 | N-[2-(5-methoxy-1H-indol-3-yl)ethyl]ace...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	7.54E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Melatonin receptor type 1A (Human)	BDBM9019 (CHEMBL45 | N-[2-(5-methoxy-1H-indol-3-yl)ethyl]ace...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	0.200	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Melatonin receptor type 1B (Human)	BDBM9019 (CHEMBL45 | N-[2-(5-methoxy-1H-indol-3-yl)ethyl]ace...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	0.530	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Melatonin receptor type 1B (Human)	BDBM9019 (CHEMBL45 | N-[2-(5-methoxy-1H-indol-3-yl)ethyl]ace...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	0.490	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Melatonin receptor type 1B (Human)	BDBM9019 (CHEMBL45 | N-[2-(5-methoxy-1H-indol-3-yl)ethyl]ace...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	0.420	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Melatonin receptor type 1A (Human)	BDBM9019 (CHEMBL45 | N-[2-(5-methoxy-1H-indol-3-yl)ethyl]ace...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	1.5	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Melatonin receptor type 1A (Human)	BDBM9019 (CHEMBL45 | N-[2-(5-methoxy-1H-indol-3-yl)ethyl]ace...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	0.200	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Melatonin receptor type 1B (Human)	BDBM9019 (CHEMBL45 | N-[2-(5-methoxy-1H-indol-3-yl)ethyl]ace...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	0.530	n/a	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Ribosyldihydronicotinamide dehydrogenase [quinone] (Human)	BDBM9019 (CHEMBL45 | N-[2-(5-methoxy-1H-indol-3-yl)ethyl]ace...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	65	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Melatonin receptor type 1A (Human)	BDBM9019 (CHEMBL45 | N-[2-(5-methoxy-1H-indol-3-yl)ethyl]ace...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	0.0260	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Melatonin receptor type 1B (Human)	BDBM9019 (CHEMBL45 | N-[2-(5-methoxy-1H-indol-3-yl)ethyl]ace...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	0.820	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Melatonin receptor type 1B (Human)	BDBM9019 (CHEMBL45 | N-[2-(5-methoxy-1H-indol-3-yl)ethyl]ace...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	0.490	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Melatonin receptor type 1A (Human)	BDBM9019 (CHEMBL45 | N-[2-(5-methoxy-1H-indol-3-yl)ethyl]ace...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	2.20	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Ribosyldihydronicotinamide dehydrogenase [quinone] (Human)	BDBM9019 (CHEMBL45 | N-[2-(5-methoxy-1H-indol-3-yl)ethyl]ace...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	6.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Ribosyldihydronicotinamide dehydrogenase [quinone] (Human)	BDBM9019 (CHEMBL45 | N-[2-(5-methoxy-1H-indol-3-yl)ethyl]ace...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.13E+4	n/a	n/a	n/a	n/a	n/a	n/a
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