BDBM217378 (S)-6-hydroxynicotine::5-[(2S)-1-methylpyrrolidin-2-yl]-1H-pyridin-2-one

SMILES: CN1CCC[C@H]1c1ccc(=O)[nH]c1

InChI Key: InChIKey=ATRCOGLZUCICIV-VIFPVBQESA-N

Data: 3 Kd

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 3 hits for monomerid = 217378   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
L-6-hydroxynicotine oxidase (LHNO N166A) (Arthrobacter nicotinovorans)	BDBM217378 ((S)-6-hydroxynicotine | 5-[(2S)-1-methylpyrrolidin...) Show SMILES CN1CCC[C@H]1c1ccc(=O)[nH]c1 Show InChI InChI=1S/C10H14N2O/c1-12-6-2-3-9(12)8-4-5-10(13)11-7-8/h4-5,7,9H,2-3,6H2,1H3,(H,11,13)/t9-/m0/s1	PDB GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	3.10E+5	n/a	n/a	n/a	8.0	298.15
University of Texas Health Science Center					Assay Description Initial rates of amine oxidation were measured by monitoring oxygen consumption using an oxygen electrode (model 5300A, Yellow Springs Instruments, Y...				Biochemistry 56: 869-875 (2017) Article DOI: 10.1021/acs.biochem.6b01160 BindingDB Entry DOI: 10.7270/Q2BR8R0F
					More data for this Ligand-Target Pair
L-6-hydroxynicotine oxidase (LHNO Y311F) (Arthrobacter nicotinovorans)	BDBM217378 ((S)-6-hydroxynicotine | 5-[(2S)-1-methylpyrrolidin...) Show SMILES CN1CCC[C@H]1c1ccc(=O)[nH]c1 Show InChI InChI=1S/C10H14N2O/c1-12-6-2-3-9(12)8-4-5-10(13)11-7-8/h4-5,7,9H,2-3,6H2,1H3,(H,11,13)/t9-/m0/s1	PDB GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	9.60E+4	n/a	n/a	n/a	8.0	298.15
University of Texas Health Science Center					Assay Description Initial rates of amine oxidation were measured by monitoring oxygen consumption using an oxygen electrode (model 5300A, Yellow Springs Instruments, Y...				Biochemistry 56: 869-875 (2017) Article DOI: 10.1021/acs.biochem.6b01160 BindingDB Entry DOI: 10.7270/Q2BR8R0F
					More data for this Ligand-Target Pair
L-6-hydroxynicotine oxidase (LHNO K287M) (Arthrobacter nicotinovorans)	BDBM217378 ((S)-6-hydroxynicotine | 5-[(2S)-1-methylpyrrolidin...) Show SMILES CN1CCC[C@H]1c1ccc(=O)[nH]c1 Show InChI InChI=1S/C10H14N2O/c1-12-6-2-3-9(12)8-4-5-10(13)11-7-8/h4-5,7,9H,2-3,6H2,1H3,(H,11,13)/t9-/m0/s1	PDB GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	6.10E+4	n/a	n/a	n/a	8.0	298.15
University of Texas Health Science Center					Assay Description Initial rates of amine oxidation were measured by monitoring oxygen consumption using an oxygen electrode (model 5300A, Yellow Springs Instruments, Y...				Biochemistry 56: 869-875 (2017) Article DOI: 10.1021/acs.biochem.6b01160 BindingDB Entry DOI: 10.7270/Q2BR8R0F
					More data for this Ligand-Target Pair