BDBM50105085 17-cyclobutylmethyl-4,5alpha-epoxymorphinan-3,6alpha,14-triol::CHEMBL895::N-cyclobutylmethyl-4,5alpha-epoxy-3,6alpha,14-morphinantriol::NALBUPHINE::US10231963, Table B.1::US10512644, Compound Nalbuphine::US11534436, Compound Table B.1::US9233167, Nalbuphine::US9656961, Example 00118::USRE49340, Rank 9

SMILES: O[C@H]1CC[C@@]2(O)[C@H]3Cc4ccc(O)c5O[C@@H]1[C@]2(CCN3CC1CCC1)c45

InChI Key: InChIKey=NETZHAKZCGBWSS-UHFFFAOYSA-N

Data: 19 KI  16 IC50  10 EC50

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 45 hits for monomerid = 50105085   

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 (Human)	BDBM50105085 (US9233167, Nalbuphine | 17-cyclobutylmethyl-4,5alp...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	353	n/a	n/a	n/a	n/a	n/a	n/a
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D-amino-acid oxidase (Human)	BDBM50105085 (US9233167, Nalbuphine | 17-cyclobutylmethyl-4,5alp...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.21E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Human)	BDBM50105085 (US9233167, Nalbuphine | 17-cyclobutylmethyl-4,5alp...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	87	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Thiosulfate sulfurtransferase (Human)	BDBM50105085 (US9233167, Nalbuphine | 17-cyclobutylmethyl-4,5alp...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
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Co-chaperonin GroES (Escherichia coli)	BDBM50105085 (US9233167, Nalbuphine | 17-cyclobutylmethyl-4,5alp...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>2.50E+5	n/a	n/a	n/a	n/a	n/a	n/a
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Chaperonin GroEL (Escherichia coli)	BDBM50105085 (US9233167, Nalbuphine | 17-cyclobutylmethyl-4,5alp...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>2.50E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
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Co-chaperonin GroES (Escherichia coli)	BDBM50105085 (US9233167, Nalbuphine | 17-cyclobutylmethyl-4,5alp...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
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60 kDa heat shock protein, mitochondrial (Human)	BDBM50105085 (US9233167, Nalbuphine | 17-cyclobutylmethyl-4,5alp...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Human)	BDBM50105085 (US9233167, Nalbuphine | 17-cyclobutylmethyl-4,5alp...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	65	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Human)	BDBM50105085 (US9233167, Nalbuphine | 17-cyclobutylmethyl-4,5alp...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	250	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Human)	BDBM50105085 (US9233167, Nalbuphine | 17-cyclobutylmethyl-4,5alp...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	34	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Human)	BDBM50105085 (US9233167, Nalbuphine | 17-cyclobutylmethyl-4,5alp...) 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
Kappa-type opioid receptor (Human)	BDBM50105085 (US9233167, Nalbuphine | 17-cyclobutylmethyl-4,5alp...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	83	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Human)	BDBM50105085 (US9233167, Nalbuphine | 17-cyclobutylmethyl-4,5alp...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	110	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Human)	BDBM50105085 (US9233167, Nalbuphine | 17-cyclobutylmethyl-4,5alp...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	27	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Human)	BDBM50105085 (US9233167, Nalbuphine | 17-cyclobutylmethyl-4,5alp...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	14	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Human)	BDBM50105085 (US9233167, Nalbuphine | 17-cyclobutylmethyl-4,5alp...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	56	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Human)	BDBM50105085 (US9233167, Nalbuphine | 17-cyclobutylmethyl-4,5alp...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	96	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Human)	BDBM50105085 (US9233167, Nalbuphine | 17-cyclobutylmethyl-4,5alp...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	46	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Human)	BDBM50105085 (US9233167, Nalbuphine | 17-cyclobutylmethyl-4,5alp...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	87	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Human)	BDBM50105085 (US9233167, Nalbuphine | 17-cyclobutylmethyl-4,5alp...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	34	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Human)	BDBM50105085 (US9233167, Nalbuphine | 17-cyclobutylmethyl-4,5alp...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	752	n/a	n/a	n/a	n/a	7.4	30
TBA									Citation and Details
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Human)	BDBM50105085 (US9233167, Nalbuphine | 17-cyclobutylmethyl-4,5alp...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	25.1	n/a	n/a	7.4	30
TBA									Citation and Details
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Human)	BDBM50105085 (US9233167, Nalbuphine | 17-cyclobutylmethyl-4,5alp...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	87	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Human)	BDBM50105085 (US9233167, Nalbuphine | 17-cyclobutylmethyl-4,5alp...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	88	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Human)	BDBM50105085 (US9233167, Nalbuphine | 17-cyclobutylmethyl-4,5alp...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	21	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Human)	BDBM50105085 (US9233167, Nalbuphine | 17-cyclobutylmethyl-4,5alp...) Show SMILES Show InChI	GoogleScholar	UniChem		0.890	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
Mu-type opioid receptor (Human)	BDBM50105085 (US9233167, Nalbuphine | 17-cyclobutylmethyl-4,5alp...) Show SMILES Show InChI	GoogleScholar	UniChem		0.980	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
Mu-type opioid receptor (Human)	BDBM50105085 (US9233167, Nalbuphine | 17-cyclobutylmethyl-4,5alp...) Show SMILES Show InChI	GoogleScholar	UniChem		0.980	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
Mu-type opioid receptor (Human)	BDBM50105085 (US9233167, Nalbuphine | 17-cyclobutylmethyl-4,5alp...) Show SMILES Show InChI	GoogleScholar	UniChem		0.980	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
Mu-type opioid receptor (Human)	BDBM50105085 (US9233167, Nalbuphine | 17-cyclobutylmethyl-4,5alp...) Show SMILES Show InChI	GoogleScholar	UniChem		1.30	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
Mu-type opioid receptor (Human)	BDBM50105085 (US9233167, Nalbuphine | 17-cyclobutylmethyl-4,5alp...) Show SMILES Show InChI	GoogleScholar	UniChem		1.60	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
Kappa-type opioid receptor (Human)	BDBM50105085 (US9233167, Nalbuphine | 17-cyclobutylmethyl-4,5alp...) Show SMILES Show InChI	GoogleScholar	UniChem		2.20	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
Kappa-type opioid receptor (Human)	BDBM50105085 (US9233167, Nalbuphine | 17-cyclobutylmethyl-4,5alp...) Show SMILES Show InChI	GoogleScholar	UniChem		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
Kappa-type opioid receptor (Human)	BDBM50105085 (US9233167, Nalbuphine | 17-cyclobutylmethyl-4,5alp...) Show SMILES Show InChI	GoogleScholar	UniChem		3.90	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
Mu-type opioid receptor (Human)	BDBM50105085 (US9233167, Nalbuphine | 17-cyclobutylmethyl-4,5alp...) Show SMILES Show InChI	GoogleScholar	UniChem		11	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
Mu-type opioid receptor (Human)	BDBM50105085 (US9233167, Nalbuphine | 17-cyclobutylmethyl-4,5alp...) Show SMILES Show InChI	GoogleScholar	UniChem		14.3	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
Mu-type opioid receptor (Human)	BDBM50105085 (US9233167, Nalbuphine | 17-cyclobutylmethyl-4,5alp...) Show SMILES Show InChI	GoogleScholar	UniChem		14.3	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
Kappa-type opioid receptor (Human)	BDBM50105085 (US9233167, Nalbuphine | 17-cyclobutylmethyl-4,5alp...) Show SMILES Show InChI	GoogleScholar	UniChem		25.9	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
Kappa-type opioid receptor (Human)	BDBM50105085 (US9233167, Nalbuphine | 17-cyclobutylmethyl-4,5alp...) Show SMILES Show InChI	GoogleScholar	UniChem		29.9	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
Delta-type opioid receptor (Human)	BDBM50105085 (US9233167, Nalbuphine | 17-cyclobutylmethyl-4,5alp...) Show SMILES Show InChI	GoogleScholar	UniChem		240	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
Delta-type opioid receptor (Human)	BDBM50105085 (US9233167, Nalbuphine | 17-cyclobutylmethyl-4,5alp...) Show SMILES Show InChI	GoogleScholar	UniChem		319	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
Delta-type opioid receptor (Human)	BDBM50105085 (US9233167, Nalbuphine | 17-cyclobutylmethyl-4,5alp...) Show SMILES Show InChI	GoogleScholar	UniChem		319	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
Delta-type opioid receptor (Human)	BDBM50105085 (US9233167, Nalbuphine | 17-cyclobutylmethyl-4,5alp...) Show SMILES Show InChI	GoogleScholar	UniChem		580	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
Delta-type opioid receptor (Human)	BDBM50105085 (US9233167, Nalbuphine | 17-cyclobutylmethyl-4,5alp...) Show SMILES Show InChI	GoogleScholar	UniChem		1.00E+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