null

SMILES: COc1cccc(COC2[C@@H](O)C(CO)O[C@@H](O[C@@H]3C(CO)O[C@@H](N=[N+]=[N-])C(NC(=O)c4cccc(OC)c4)C3O)C2O)c1

InChI Key: InChIKey=DWUKAHVHRRUFNS-IRTIXXTFSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 223992   

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
Galectin-1 [C3S] (Homo sapiens (Human))	BDBM223992 (4-O-[3-O-(3-methoxybenzyl)-β-D-galactopyranos...) Show SMILES COc1cccc(COC2[C@@H](O)C(CO)O[C@@H](O[C@@H]3C(CO)O[C@@H](N=[N+]=[N-])C(NC(=O)c4cccc(OC)c4)C3O)C2O)c1 |r| Show InChI InChI=1S/C28H36N4O12/c1-39-16-7-3-5-14(9-16)13-41-25-21(35)18(11-33)43-28(23(25)37)44-24-19(12-34)42-27(31-32-29)20(22(24)36)30-26(38)15-6-4-8-17(10-15)40-2/h3-10,18-25,27-28,33-37H,11-13H2,1-2H3,(H,30,38)/t18?,19?,20?,21-,22?,23?,24+,25?,27+,28-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	2.30E+4	n/a	n/a	n/a	n/a	4
Université de Nantes					Assay Description Fluorescence anisotropy was measured on a Tecan infinite M1000 plate reader with an excitation at 470 nm and emission at 525 nm, using Greiner 96 fla...				Chembiochem 18: 782-789 (2017) Article DOI: 10.1002/cbic.201600673 BindingDB Entry DOI: 10.7270/Q2HQ3XRP
					More data for this Ligand-Target Pair
Galectin-7 (Homo sapiens (Human))	BDBM223992 (4-O-[3-O-(3-methoxybenzyl)-β-D-galactopyranos...) Show SMILES COc1cccc(COC2[C@@H](O)C(CO)O[C@@H](O[C@@H]3C(CO)O[C@@H](N=[N+]=[N-])C(NC(=O)c4cccc(OC)c4)C3O)C2O)c1 |r| Show InChI InChI=1S/C28H36N4O12/c1-39-16-7-3-5-14(9-16)13-41-25-21(35)18(11-33)43-28(23(25)37)44-24-19(12-34)42-27(31-32-29)20(22(24)36)30-26(38)15-6-4-8-17(10-15)40-2/h3-10,18-25,27-28,33-37H,11-13H2,1-2H3,(H,30,38)/t18?,19?,20?,21-,22?,23?,24+,25?,27+,28-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	8.60E+4	n/a	n/a	n/a	n/a	4
Université de Nantes					Assay Description Fluorescence anisotropy was measured on a Tecan infinite M1000 plate reader with an excitation at 470 nm and emission at 525 nm, using Greiner 96 fla...				Chembiochem 18: 782-789 (2017) Article DOI: 10.1002/cbic.201600673 BindingDB Entry DOI: 10.7270/Q2HQ3XRP
					More data for this Ligand-Target Pair
Galectin-3 (Homo sapiens (Human))	BDBM223992 (4-O-[3-O-(3-methoxybenzyl)-β-D-galactopyranos...) Show SMILES COc1cccc(COC2[C@@H](O)C(CO)O[C@@H](O[C@@H]3C(CO)O[C@@H](N=[N+]=[N-])C(NC(=O)c4cccc(OC)c4)C3O)C2O)c1 |r| Show InChI InChI=1S/C28H36N4O12/c1-39-16-7-3-5-14(9-16)13-41-25-21(35)18(11-33)43-28(23(25)37)44-24-19(12-34)42-27(31-32-29)20(22(24)36)30-26(38)15-6-4-8-17(10-15)40-2/h3-10,18-25,27-28,33-37H,11-13H2,1-2H3,(H,30,38)/t18?,19?,20?,21-,22?,23?,24+,25?,27+,28-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	3.27E+3	n/a	n/a	n/a	n/a	25
Université de Nantes					Assay Description Fluorescence anisotropy was measured on a Tecan infinite M1000 plate reader with an excitation at 470 nm and emission at 525 nm, using Greiner 96 fla...				Chembiochem 18: 782-789 (2017) Article DOI: 10.1002/cbic.201600673 BindingDB Entry DOI: 10.7270/Q2HQ3XRP
					More data for this Ligand-Target Pair
Galectin-3 (Homo sapiens (Human))	BDBM223992 (4-O-[3-O-(3-methoxybenzyl)-β-D-galactopyranos...) Show SMILES COc1cccc(COC2[C@@H](O)C(CO)O[C@@H](O[C@@H]3C(CO)O[C@@H](N=[N+]=[N-])C(NC(=O)c4cccc(OC)c4)C3O)C2O)c1 |r| Show InChI InChI=1S/C28H36N4O12/c1-39-16-7-3-5-14(9-16)13-41-25-21(35)18(11-33)43-28(23(25)37)44-24-19(12-34)42-27(31-32-29)20(22(24)36)30-26(38)15-6-4-8-17(10-15)40-2/h3-10,18-25,27-28,33-37H,11-13H2,1-2H3,(H,30,38)/t18?,19?,20?,21-,22?,23?,24+,25?,27+,28-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	660	n/a	n/a	n/a	n/a	4
Université de Nantes					Assay Description Fluorescence anisotropy was measured on a Tecan infinite M1000 plate reader with an excitation at 470 nm and emission at 525 nm, using Greiner 96 fla...				Chembiochem 18: 782-789 (2017) Article DOI: 10.1002/cbic.201600673 BindingDB Entry DOI: 10.7270/Q2HQ3XRP
					More data for this Ligand-Target Pair