BDBM50247803 Beta-Funeltrexamine::CHEMBL473136::beta-funaltrexamine::methyl (2E)-3-{[(1S,5R,13R,14R,17S)-4-(cyclopropylmethyl)-10,17-dihydroxy-12-oxa-4-azapentacyclo[9.6.1.0^{1,13}.0^{5,17}.0^{7,18}]octadeca-7(18),8,10-trien-14-yl]carbamoyl}prop-2-enoate::methyl 3-[4-cyclopropylmethyl-10,17-dihydroxy-12-oxa-4-azapentacyclo[9.6.1.01,13.05,17.07,18]octadeca-7(18),8,10-trien-14-ylcarbamoyl]-(E)-2-propenoate

SMILES: COC(=O)\C=C\C(=O)N[C@@H]1CC[C@@]2(O)[C@H]3Cc4ccc(O)c5O[C@@H]1[C@]2(CCN3CC1CC1)c45

InChI Key: InChIKey=PQKHESYTSKMWFP-UHFFFAOYSA-N

Data: 13 KI  5 IC50

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 18 hits for monomerid = 50247803   

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
Delta-type opioid receptor/Kappa-type opioid receptor/Mu-type opioid receptor/Sigma non-opioid intracellular receptor 1 (Rat)	BDBM50247803 (Beta-Funeltrexamine | beta-funaltrexamine | methyl...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1	n/a	n/a	n/a	n/a	n/a	n/a
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Delta-type opioid receptor/Kappa-type opioid receptor/Mu-type opioid receptor/Sigma non-opioid intracellular receptor 1 (Mouse)	BDBM50247803 (Beta-Funeltrexamine | beta-funaltrexamine | methyl...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	82	n/a	n/a	n/a	n/a	n/a	n/a
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Mu-type opioid receptor (Guinea pig)	BDBM50247803 (Beta-Funeltrexamine | beta-funaltrexamine | methyl...) 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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Mu-type opioid receptor (Guinea pig)	BDBM50247803 (Beta-Funeltrexamine | beta-funaltrexamine | methyl...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	4.80	n/a	n/a	n/a	n/a	n/a	n/a
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Mu-type opioid receptor (Mouse)	BDBM50247803 (Beta-Funeltrexamine | beta-funaltrexamine | methyl...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	82	n/a	n/a	n/a	n/a	n/a	n/a
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Mu-type opioid receptor (Guinea pig)	BDBM50247803 (Beta-Funeltrexamine | beta-funaltrexamine | methyl...) Show SMILES Show InChI	GoogleScholar	UniChem		0.400	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Mu-type opioid receptor (Guinea pig)	BDBM50247803 (Beta-Funeltrexamine | beta-funaltrexamine | methyl...) Show SMILES Show InChI	GoogleScholar	UniChem		0.400	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Mu-type opioid receptor (Human)	BDBM50247803 (Beta-Funeltrexamine | beta-funaltrexamine | methyl...) Show SMILES Show InChI	GoogleScholar	UniChem		0.410	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Mu-type opioid receptor (Human)	BDBM50247803 (Beta-Funeltrexamine | beta-funaltrexamine | methyl...) Show SMILES Show InChI	GoogleScholar	UniChem		0.410	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Kappa-type opioid receptor (Guinea pig)	BDBM50247803 (Beta-Funeltrexamine | beta-funaltrexamine | methyl...) Show SMILES Show InChI	GoogleScholar	UniChem		0.900	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Kappa-type opioid receptor (Guinea pig)	BDBM50247803 (Beta-Funeltrexamine | beta-funaltrexamine | methyl...) Show SMILES Show InChI	GoogleScholar	UniChem		0.900	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Kappa-type opioid receptor (Human)	BDBM50247803 (Beta-Funeltrexamine | beta-funaltrexamine | methyl...) Show SMILES Show InChI	GoogleScholar	UniChem		0.940	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Kappa-type opioid receptor (Human)	BDBM50247803 (Beta-Funeltrexamine | beta-funaltrexamine | methyl...) Show SMILES Show InChI	GoogleScholar	UniChem		0.940	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Delta-type opioid receptor (Human)	BDBM50247803 (Beta-Funeltrexamine | beta-funaltrexamine | methyl...) Show SMILES Show InChI	GoogleScholar	UniChem		22	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Delta-type opioid receptor (Human)	BDBM50247803 (Beta-Funeltrexamine | beta-funaltrexamine | methyl...) Show SMILES Show InChI	GoogleScholar	UniChem		28	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
Delta-type opioid receptor (Human)	BDBM50247803 (Beta-Funeltrexamine | beta-funaltrexamine | methyl...) Show SMILES Show InChI	GoogleScholar	UniChem		28	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Kappa-type opioid receptor (Guinea pig)	BDBM50247803 (Beta-Funeltrexamine | beta-funaltrexamine | methyl...) Show SMILES Show InChI	GoogleScholar	UniChem		67	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Neuropeptides B/W receptor type 1 (Human)	BDBM50247803 (Beta-Funeltrexamine | beta-funaltrexamine | methyl...) Show SMILES Show InChI	GoogleScholar	UniChem		93	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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