BDBM50098549 (6aR,aR)-3-Methyl-2-(6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-11-yl)-benzonitrile::(6aR,aS)-3-Methyl-2-(6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-11-yl)-benzonitrile::3-Methyl-2-((R)-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-11-yl)-benzonitrile::CHEMBL28056

SMILES: CN1CCc2cccc-3c2[C@H]1Cc1cccc(-c2c(C)cccc2C#N)c-31

InChI Key: InChIKey=APEZAWGOFKUHCA-UHFFFAOYSA-N

Data: 23 KI

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 23 hits for monomerid = 50098549   

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
5-hydroxytryptamine receptor 7 (Human)	BDBM50098549 ((6aR,aS)-3-Methyl-2-(6-methyl-5,6,6a,7-tetrahydro-...) Show SMILES Show InChI	GoogleScholar	UniChem		1	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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5-hydroxytryptamine receptor 7 (Rat)	BDBM50098549 ((6aR,aS)-3-Methyl-2-(6-methyl-5,6,6a,7-tetrahydro-...) Show SMILES Show InChI	GoogleScholar	UniChem		3.79	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
5-hydroxytryptamine receptor 7 (Rat)	BDBM50098549 ((6aR,aS)-3-Methyl-2-(6-methyl-5,6,6a,7-tetrahydro-...) Show SMILES Show InChI	GoogleScholar	UniChem		3.80	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 7 (Human)	BDBM50098549 ((6aR,aS)-3-Methyl-2-(6-methyl-5,6,6a,7-tetrahydro-...) Show SMILES Show InChI	GoogleScholar	UniChem		3.80	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
5-hydroxytryptamine receptor 7 (Rat)	BDBM50098549 ((6aR,aS)-3-Methyl-2-(6-methyl-5,6,6a,7-tetrahydro-...) Show SMILES Show InChI	GoogleScholar	UniChem		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
5-hydroxytryptamine receptor 7 (Human)	BDBM50098549 ((6aR,aS)-3-Methyl-2-(6-methyl-5,6,6a,7-tetrahydro-...) Show SMILES Show InChI	GoogleScholar	UniChem		20.8	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
5-hydroxytryptamine receptor 7 (Human)	BDBM50098549 ((6aR,aS)-3-Methyl-2-(6-methyl-5,6,6a,7-tetrahydro-...) Show SMILES Show InChI	GoogleScholar	UniChem		20.8	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
5-hydroxytryptamine receptor 7 (Rat)	BDBM50098549 ((6aR,aS)-3-Methyl-2-(6-methyl-5,6,6a,7-tetrahydro-...) Show SMILES Show InChI	GoogleScholar	UniChem		20.8	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
5-hydroxytryptamine receptor 7 (Rat)	BDBM50098549 ((6aR,aS)-3-Methyl-2-(6-methyl-5,6,6a,7-tetrahydro-...) Show SMILES Show InChI	GoogleScholar	UniChem		20.8	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Sodium-dependent serotonin transporter (Rat)	BDBM50098549 ((6aR,aS)-3-Methyl-2-(6-methyl-5,6,6a,7-tetrahydro-...) Show SMILES Show InChI	GoogleScholar	UniChem		21	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rat)	BDBM50098549 ((6aR,aS)-3-Methyl-2-(6-methyl-5,6,6a,7-tetrahydro-...) Show SMILES Show InChI	GoogleScholar	UniChem		21	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Rat)	BDBM50098549 ((6aR,aS)-3-Methyl-2-(6-methyl-5,6,6a,7-tetrahydro-...) Show SMILES Show InChI	GoogleScholar	UniChem		140	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
5-hydroxytryptamine receptor 1A (Rat)	BDBM50098549 ((6aR,aS)-3-Methyl-2-(6-methyl-5,6,6a,7-tetrahydro-...) Show SMILES Show InChI	GoogleScholar	UniChem		140	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
5-hydroxytryptamine receptor 1A (Human)	BDBM50098549 ((6aR,aS)-3-Methyl-2-(6-methyl-5,6,6a,7-tetrahydro-...) Show SMILES Show InChI	GoogleScholar	UniChem		142	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
5-hydroxytryptamine receptor 1A (Rat)	BDBM50098549 ((6aR,aS)-3-Methyl-2-(6-methyl-5,6,6a,7-tetrahydro-...) Show SMILES Show InChI	GoogleScholar	UniChem		142	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
5-hydroxytryptamine receptor 1A (Human)	BDBM50098549 ((6aR,aS)-3-Methyl-2-(6-methyl-5,6,6a,7-tetrahydro-...) Show SMILES Show InChI	GoogleScholar	UniChem		142	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
D(2) dopamine receptor (Rat)	BDBM50098549 ((6aR,aS)-3-Methyl-2-(6-methyl-5,6,6a,7-tetrahydro-...) Show SMILES Show InChI	GoogleScholar	UniChem		498	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
D(2) dopamine receptor (Rat)	BDBM50098549 ((6aR,aS)-3-Methyl-2-(6-methyl-5,6,6a,7-tetrahydro-...) Show SMILES Show InChI	GoogleScholar	UniChem		500	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
D(2) dopamine receptor (Rat)	BDBM50098549 ((6aR,aS)-3-Methyl-2-(6-methyl-5,6,6a,7-tetrahydro-...) Show SMILES Show InChI	GoogleScholar	UniChem		500	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
5-hydroxytryptamine receptor 1A (Human)	BDBM50098549 ((6aR,aS)-3-Methyl-2-(6-methyl-5,6,6a,7-tetrahydro-...) Show SMILES Show InChI	GoogleScholar	UniChem		778	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
5-hydroxytryptamine receptor 1A (Human)	BDBM50098549 ((6aR,aS)-3-Methyl-2-(6-methyl-5,6,6a,7-tetrahydro-...) Show SMILES Show InChI	GoogleScholar	UniChem		778	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
D(2) dopamine receptor (Human)	BDBM50098549 ((6aR,aS)-3-Methyl-2-(6-methyl-5,6,6a,7-tetrahydro-...) Show SMILES Show InChI	GoogleScholar	UniChem		2.47E+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
D(2) dopamine receptor (Human)	BDBM50098549 ((6aR,aS)-3-Methyl-2-(6-methyl-5,6,6a,7-tetrahydro-...) Show SMILES Show InChI	GoogleScholar	UniChem		2.47E+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