BDBM50427121 CHEMBL2323429::CHEMBL2323430

SMILES: C[n+]1ccn(CCCCCCCCCCCCCCCCCCCCn2cc[n+](C)c2)c1

InChI Key: InChIKey=TWIPDBLUSZBZGE-UHFFFAOYSA-N

Data: 4 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 4 hits for monomerid = 50427121   

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
β-1,4-Galactosyltransferase I (β4GalT) (Bos taurus (Cattle))	BDBM50427121 (CHEMBL2323429 | CHEMBL2323430) Show SMILES C[n+]1ccn(CCCCCCCCCCCCCCCCCCCCn2cc[n+](C)c2)c1 Show InChI InChI=1S/C28H52N4/c1-29-23-25-31(27-29)21-19-17-15-13-11-9-7-5-3-4-6-8-10-12-14-16-18-20-22-32-26-24-30(2)28-32/h23-28H,3-22H2,1-2H3/q+2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.30E+5	n/a	n/a	n/a	n/a	n/a	n/a
Queen's University Curated by ChEMBL					Assay Description Inhibition of bovine milk beta4-GalT1 using GlcNAcbeta-Bn as substrate after 1 hr relative to control				Bioorg Med Chem 21: 1305-11 (2013) Article DOI: 10.1016/j.bmc.2012.12.034 BindingDB Entry DOI: 10.7270/Q2J67J72
					More data for this Ligand-Target Pair
Beta-1,3-galactosyltransferase 1 (Homo sapiens (Human))	BDBM50427121 (CHEMBL2323429 | CHEMBL2323430) Show SMILES C[n+]1ccn(CCCCCCCCCCCCCCCCCCCCn2cc[n+](C)c2)c1 Show InChI InChI=1S/C28H52N4/c1-29-23-25-31(27-29)21-19-17-15-13-11-9-7-5-3-4-6-8-10-12-14-16-18-20-22-32-26-24-30(2)28-32/h23-28H,3-22H2,1-2H3/q+2	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.40E+5	n/a	n/a	n/a	n/a	n/a	n/a
Queen's University Curated by ChEMBL					Assay Description Inhibition of human recombinant soluble His-tagged beta3-GalT1 expressed in insect cells using GlcNAcbeta-Bn as substrate after 1 hr				Bioorg Med Chem 21: 1305-11 (2013) Article DOI: 10.1016/j.bmc.2012.12.034 BindingDB Entry DOI: 10.7270/Q2J67J72
					More data for this Ligand-Target Pair
Beta-1,3-galactosyltransferase 1 (Homo sapiens (Human))	BDBM50427121 (CHEMBL2323429 | CHEMBL2323430) Show SMILES C[n+]1ccn(CCCCCCCCCCCCCCCCCCCCn2cc[n+](C)c2)c1 Show InChI InChI=1S/C28H52N4/c1-29-23-25-31(27-29)21-19-17-15-13-11-9-7-5-3-4-6-8-10-12-14-16-18-20-22-32-26-24-30(2)28-32/h23-28H,3-22H2,1-2H3/q+2	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.20E+5	n/a	n/a	n/a	n/a	n/a	n/a
Queen's University Curated by ChEMBL					Assay Description Inhibition of human recombinant soluble His-tagged beta3-GalT1 expressed in insect cells using GlcNAcbeta-Bn as substrate after 1 hr				Bioorg Med Chem 21: 1305-11 (2013) Article DOI: 10.1016/j.bmc.2012.12.034 BindingDB Entry DOI: 10.7270/Q2J67J72
					More data for this Ligand-Target Pair
Beta-1,4-galactosyltransferase 1 (Homo sapiens (Human))	BDBM50427121 (CHEMBL2323429 | CHEMBL2323430) Show SMILES C[n+]1ccn(CCCCCCCCCCCCCCCCCCCCn2cc[n+](C)c2)c1 Show InChI InChI=1S/C28H52N4/c1-29-23-25-31(27-29)21-19-17-15-13-11-9-7-5-3-4-6-8-10-12-14-16-18-20-22-32-26-24-30(2)28-32/h23-28H,3-22H2,1-2H3/q+2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.96E+6	n/a	n/a	n/a	n/a	n/a	n/a
Queen's University Curated by ChEMBL					Assay Description Inhibition of human recombinant soluble His-tagged beta4-GalT1 expressed in Escherichia coli BL21 using GlcNAcbeta-Bn as substrate after 1 hr relativ...				Bioorg Med Chem 21: 1305-11 (2013) Article DOI: 10.1016/j.bmc.2012.12.034 BindingDB Entry DOI: 10.7270/Q2J67J72
					More data for this Ligand-Target Pair