Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Nicotinamide N-methyltransferase' and Ligand = 'BDBM50530715'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Nicotinamide N-methyltransferase (Homo sapiens (Human))	BDBM50530715 (CHEMBL4466178) Show SMILES N[C@@H](CC[C@@H](C[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12)C#Cc1ccc2CCNC(=O)c2c1)C(O)=O |r| Show InChI InChI=1S/C26H29N7O6/c27-17(26(37)38)6-4-14(2-1-13-3-5-15-7-8-29-24(36)16(15)9-13)10-18-20(34)21(35)25(39-18)33-12-32-19-22(28)30-11-31-23(19)33/h3,5,9,11-12,14,17-18,20-21,25,34-35H,4,6-8,10,27H2,(H,29,36)(H,37,38)(H2,28,30,31)/t14-,17-,18+,20+,21+,25+/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	55	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
BioKin Ltd. Curated by ChEMBL					Assay Description Inhibition of N-terminal His6-tagged wild type human NNMT expressed in Escherichia coli NiCo21(DE3) assessed as reduction in 1-methylquinolinium leve...				J Med Chem 62: 9837-9873 (2019) Article DOI: 10.1021/acs.jmedchem.9b01238 BindingDB Entry DOI: 10.7270/Q2D50RDJ
					More data for this Ligand-Target Pair
Nicotinamide N-methyltransferase (Homo sapiens (Human))	BDBM50530715 (CHEMBL4466178) Show SMILES N[C@@H](CC[C@@H](C[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12)C#Cc1ccc2CCNC(=O)c2c1)C(O)=O |r| Show InChI InChI=1S/C26H29N7O6/c27-17(26(37)38)6-4-14(2-1-13-3-5-15-7-8-29-24(36)16(15)9-13)10-18-20(34)21(35)25(39-18)33-12-32-19-22(28)30-11-31-23(19)33/h3,5,9,11-12,14,17-18,20-21,25,34-35H,4,6-8,10,27H2,(H,29,36)(H,37,38)(H2,28,30,31)/t14-,17-,18+,20+,21+,25+/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	55	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
BioKin Ltd. Curated by ChEMBL					Assay Description Inhibition of N-terminal His6-tagged wild type human NNMT expressed in Escherichia coli NiCo21(DE3) assessed as reduction in 1-methylquinolinium leve...				J Med Chem 62: 9837-9873 (2019) Article DOI: 10.1021/acs.jmedchem.9b01238 BindingDB Entry DOI: 10.7270/Q2D50RDJ
					More data for this Ligand-Target Pair