BDBM50056445 1,1-diethyl-3-[(8alpha)-6-methyl-9,10-didehydroergolin-8-yl]urea::CHEMBL157138::N'-((8alpha)-9,10-Didehydro-6-methylergolin-8-yl)-N,N-diethylurea::US20240279226, Example 12::lisuride::lisuride, (S)

SMILES: CCN(CC)C(=O)N[C@@H]1CN([C@@H]2Cc3c[nH]c4c3c(ccc4)C2=C1)C

InChI Key: InChIKey=BKRGVLQUQGGVSM-UHFFFAOYSA-N

Data: 10 KI  2 IC50  8 Kd  1 EC50

PDB links: 4 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 73 hits for monomerid = 50056445   

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 2C (Human)	BDBM50056445 (lisuride, (S) | lisuride | N'-((8alpha)-9,10-Dideh...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	26	n/a	n/a	n/a	n/a	n/a	n/a
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5-hydroxytryptamine receptor 1D (Pig)	BDBM50056445 (lisuride, (S) | lisuride | N'-((8alpha)-9,10-Dideh...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a
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Serotonin 2 (5-HT2) receptor (Rat)	BDBM50056445 (lisuride, (S) | lisuride | N'-((8alpha)-9,10-Dideh...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	>5.01E+3	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2C (Human)	BDBM50056445 (lisuride, (S) | lisuride | N'-((8alpha)-9,10-Dideh...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	5.01E+4	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)	BDBM50056445 (lisuride, (S) | lisuride | N'-((8alpha)-9,10-Dideh...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	501	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)	BDBM50056445 (lisuride, (S) | lisuride | N'-((8alpha)-9,10-Dideh...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	0.600	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)	BDBM50056445 (lisuride, (S) | lisuride | N'-((8alpha)-9,10-Dideh...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	0.400	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)	BDBM50056445 (lisuride, (S) | lisuride | N'-((8alpha)-9,10-Dideh...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	2.30	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)	BDBM50056445 (lisuride, (S) | lisuride | N'-((8alpha)-9,10-Dideh...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	0.300	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
D(4) dopamine receptor (Human)	BDBM50056445 (lisuride, (S) | lisuride | N'-((8alpha)-9,10-Dideh...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	89	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2C (Human)	BDBM50056445 (lisuride, (S) | lisuride | N'-((8alpha)-9,10-Dideh...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	203	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2C (Human)	BDBM50056445 (lisuride, (S) | lisuride | N'-((8alpha)-9,10-Dideh...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	2.36E+4	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2A (Human)	BDBM50056445 (lisuride, (S) | lisuride | N'-((8alpha)-9,10-Dideh...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	0.970	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 2A (Human)	BDBM50056445 (lisuride, (S) | lisuride | N'-((8alpha)-9,10-Dideh...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	343	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Human)	BDBM50056445 (lisuride, (S) | lisuride | N'-((8alpha)-9,10-Dideh...) Show SMILES Show InChI	GoogleScholar	UniChem		0.300	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)	BDBM50056445 (lisuride, (S) | lisuride | N'-((8alpha)-9,10-Dideh...) Show SMILES Show InChI	GoogleScholar	UniChem		0.300	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(1A) dopamine receptor (Human)	BDBM50056445 (lisuride, (S) | lisuride | N'-((8alpha)-9,10-Dideh...) Show SMILES Show InChI	GoogleScholar	UniChem		0.340	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)	BDBM50056445 (lisuride, (S) | lisuride | N'-((8alpha)-9,10-Dideh...) Show SMILES Show InChI	GoogleScholar	UniChem		0.340	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)	BDBM50056445 (lisuride, (S) | lisuride | N'-((8alpha)-9,10-Dideh...) Show SMILES Show InChI	GoogleScholar	UniChem		0.400	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
Alpha-2C adrenergic receptor (Human)	BDBM50056445 (lisuride, (S) | lisuride | N'-((8alpha)-9,10-Dideh...) Show SMILES Show InChI	GoogleScholar	UniChem		0.400	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
Alpha-2B adrenergic receptor (Human)	BDBM50056445 (lisuride, (S) | lisuride | N'-((8alpha)-9,10-Dideh...) Show SMILES Show InChI	GoogleScholar	UniChem		0.5	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
D(2) dopamine receptor (Human)	BDBM50056445 (lisuride, (S) | lisuride | N'-((8alpha)-9,10-Dideh...) Show SMILES Show InChI	GoogleScholar	UniChem		0.5	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
5-hydroxytryptamine receptor 1A (Human)	BDBM50056445 (lisuride, (S) | lisuride | N'-((8alpha)-9,10-Dideh...) Show SMILES Show InChI	GoogleScholar	UniChem		0.5	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
D(2) dopamine receptor (Human)	BDBM50056445 (lisuride, (S) | lisuride | N'-((8alpha)-9,10-Dideh...) Show SMILES Show InChI	GoogleScholar	UniChem		0.660	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)	BDBM50056445 (lisuride, (S) | lisuride | N'-((8alpha)-9,10-Dideh...) Show SMILES Show InChI	GoogleScholar	UniChem		0.800	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 2B (Human)	BDBM50056445 (lisuride, (S) | lisuride | N'-((8alpha)-9,10-Dideh...) Show SMILES Show InChI	GoogleScholar	UniChem		1.10	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(3) dopamine receptor (Human)	BDBM50056445 (lisuride, (S) | lisuride | N'-((8alpha)-9,10-Dideh...) Show SMILES Show InChI	GoogleScholar	UniChem		1.70	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(3) dopamine receptor (Human)	BDBM50056445 (lisuride, (S) | lisuride | N'-((8alpha)-9,10-Dideh...) Show SMILES Show InChI	GoogleScholar	UniChem		1.70	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
Alpha-2A adrenergic receptor (Human)	BDBM50056445 (lisuride, (S) | lisuride | N'-((8alpha)-9,10-Dideh...) Show SMILES Show InChI	GoogleScholar	UniChem		1.80	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
Alpha-2A adrenergic receptor (Human)	BDBM50056445 (lisuride, (S) | lisuride | N'-((8alpha)-9,10-Dideh...) Show SMILES Show InChI	GoogleScholar	UniChem		2	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 2B (Human)	BDBM50056445 (lisuride, (S) | lisuride | N'-((8alpha)-9,10-Dideh...) Show SMILES Show InChI	GoogleScholar	UniChem		2.90	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 5A (Human)	BDBM50056445 (lisuride, (S) | lisuride | N'-((8alpha)-9,10-Dideh...) Show SMILES Show InChI	GoogleScholar	UniChem		3.10	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(4) dopamine receptor (Human)	BDBM50056445 (lisuride, (S) | lisuride | N'-((8alpha)-9,10-Dideh...) Show SMILES Show InChI	GoogleScholar	UniChem		3.20	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(4) dopamine receptor (Human)	BDBM50056445 (lisuride, (S) | lisuride | N'-((8alpha)-9,10-Dideh...) 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 2A (Human)	BDBM50056445 (lisuride, (S) | lisuride | N'-((8alpha)-9,10-Dideh...) Show SMILES Show InChI	GoogleScholar	UniChem		5.10	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 2A (Human)	BDBM50056445 (lisuride, (S) | lisuride | N'-((8alpha)-9,10-Dideh...) Show SMILES Show InChI	GoogleScholar	UniChem		5.40	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)	BDBM50056445 (lisuride, (S) | lisuride | N'-((8alpha)-9,10-Dideh...) Show SMILES Show InChI	GoogleScholar	UniChem		6.70	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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5-hydroxytryptamine receptor 7 (Human)	BDBM50056445 (lisuride, (S) | lisuride | N'-((8alpha)-9,10-Dideh...) Show SMILES Show InChI	GoogleScholar	UniChem		6.80	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
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5-hydroxytryptamine receptor 6 (Human)	BDBM50056445 (lisuride, (S) | lisuride | N'-((8alpha)-9,10-Dideh...) Show SMILES Show InChI	GoogleScholar	UniChem		7.30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Beta-1 adrenergic receptor (Human)	BDBM50056445 (lisuride, (S) | lisuride | N'-((8alpha)-9,10-Dideh...) Show SMILES Show InChI	GoogleScholar	UniChem		8.20	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 1B (Human)	BDBM50056445 (lisuride, (S) | lisuride | N'-((8alpha)-9,10-Dideh...) Show SMILES Show InChI	GoogleScholar	UniChem		16	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
Alpha-1A adrenergic receptor (Human)	BDBM50056445 (lisuride, (S) | lisuride | N'-((8alpha)-9,10-Dideh...) Show SMILES Show InChI	GoogleScholar	UniChem		24.6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Beta-2 adrenergic receptor (Human)	BDBM50056445 (lisuride, (S) | lisuride | N'-((8alpha)-9,10-Dideh...) Show SMILES Show InChI	GoogleScholar	UniChem		35.3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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5-hydroxytryptamine receptor 1E (Human)	BDBM50056445 (lisuride, (S) | lisuride | N'-((8alpha)-9,10-Dideh...) Show SMILES Show InChI	GoogleScholar	UniChem		44.3	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
Alpha-1A adrenergic receptor (Human)	BDBM50056445 (lisuride, (S) | lisuride | N'-((8alpha)-9,10-Dideh...) Show SMILES Show InChI	GoogleScholar	UniChem		55	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(1A) dopamine receptor (Human)	BDBM50056445 (lisuride, (S) | lisuride | N'-((8alpha)-9,10-Dideh...) Show SMILES Show InChI	GoogleScholar	UniChem		62	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(1A) dopamine receptor (Human)	BDBM50056445 (lisuride, (S) | lisuride | N'-((8alpha)-9,10-Dideh...) Show SMILES Show InChI	GoogleScholar	UniChem		77	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(1B) dopamine receptor (Human)	BDBM50056445 (lisuride, (S) | lisuride | N'-((8alpha)-9,10-Dideh...) Show SMILES Show InChI	GoogleScholar	UniChem		77	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Histamine H2 receptor (Human)	BDBM50056445 (lisuride, (S) | lisuride | N'-((8alpha)-9,10-Dideh...) Show SMILES Show InChI	GoogleScholar	UniChem		114	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Carnitine O-palmitoyltransferase 2, mitochondrial (Human)	BDBM50056445 (lisuride, (S) | lisuride | N'-((8alpha)-9,10-Dideh...) Show SMILES Show InChI	GoogleScholar	UniChem		136	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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