BDBM50509532 CHEMBL4465115

SMILES: OC[C@H]1O[C@H](Sc2ccc(Cl)c(Cl)c2)[C@H](O)[C@@H](Nc2cccc(Cl)c2)[C@H]1O

InChI Key: InChIKey=FKUBEGFGZGNZHU-DISONHOPSA-N

Data: 7 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 7 hits for monomerid = 50509532   

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-7 (Homo sapiens (Human))	BDBM50509532 (CHEMBL4465115) Show SMILES OC[C@H]1O[C@H](Sc2ccc(Cl)c(Cl)c2)[C@H](O)[C@@H](Nc2cccc(Cl)c2)[C@H]1O |r| Show InChI InChI=1S/C18H18Cl3NO4S/c19-9-2-1-3-10(6-9)22-15-16(24)14(8-23)26-18(17(15)25)27-11-4-5-12(20)13(21)7-11/h1-7,14-18,22-25H,8H2/t14-,15+,16+,17-,18-/m1/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	1.70E+4	n/a	n/a	n/a	n/a	n/a
Lund University Curated by ChEMBL					Assay Description Binding affinity at recombinant human Galectin 7 expressed in Escherichia coli BL21 incubated for 5 mins by fluorescence anisotropy assay				ACS Med Chem Lett 11: 34-39 (2020) Article DOI: 10.1021/acsmedchemlett.9b00396
					More data for this Ligand-Target Pair
Galectin-8 (Homo sapiens (Human))	BDBM50509532 (CHEMBL4465115) Show SMILES OC[C@H]1O[C@H](Sc2ccc(Cl)c(Cl)c2)[C@H](O)[C@@H](Nc2cccc(Cl)c2)[C@H]1O |r| Show InChI InChI=1S/C18H18Cl3NO4S/c19-9-2-1-3-10(6-9)22-15-16(24)14(8-23)26-18(17(15)25)27-11-4-5-12(20)13(21)7-11/h1-7,14-18,22-25H,8H2/t14-,15+,16+,17-,18-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	4.40E+5	n/a	n/a	n/a	n/a	n/a
Lund University Curated by ChEMBL					Assay Description Binding affinity at recombinant human N-terminal Galectin 8 expressed in Escherichia coli BL21 incubated for 5 mins by fluorescence anisotropy assay				ACS Med Chem Lett 11: 34-39 (2020) Article DOI: 10.1021/acsmedchemlett.9b00396
					More data for this Ligand-Target Pair
Galectin-9 (Homo sapiens (Human))	BDBM50509532 (CHEMBL4465115) Show SMILES OC[C@H]1O[C@H](Sc2ccc(Cl)c(Cl)c2)[C@H](O)[C@@H](Nc2cccc(Cl)c2)[C@H]1O |r| Show InChI InChI=1S/C18H18Cl3NO4S/c19-9-2-1-3-10(6-9)22-15-16(24)14(8-23)26-18(17(15)25)27-11-4-5-12(20)13(21)7-11/h1-7,14-18,22-25H,8H2/t14-,15+,16+,17-,18-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	1.40E+4	n/a	n/a	n/a	n/a	n/a
Lund University Curated by ChEMBL					Assay Description Binding affinity at recombinant human N-terminal Galectin 9 expressed in Escherichia coli BL21 incubated for 5 mins by fluorescence anisotropy assay				ACS Med Chem Lett 11: 34-39 (2020) Article DOI: 10.1021/acsmedchemlett.9b00396
					More data for this Ligand-Target Pair
Galectin-9 (Homo sapiens (Human))	BDBM50509532 (CHEMBL4465115) Show SMILES OC[C@H]1O[C@H](Sc2ccc(Cl)c(Cl)c2)[C@H](O)[C@@H](Nc2cccc(Cl)c2)[C@H]1O |r| Show InChI InChI=1S/C18H18Cl3NO4S/c19-9-2-1-3-10(6-9)22-15-16(24)14(8-23)26-18(17(15)25)27-11-4-5-12(20)13(21)7-11/h1-7,14-18,22-25H,8H2/t14-,15+,16+,17-,18-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	4.60E+3	n/a	n/a	n/a	n/a	n/a
Lund University Curated by ChEMBL					Assay Description Binding affinity at recombinant human C-terminal Galectin 9 expressed in Escherichia coli BL21 incubated for 5 mins by fluorescence anisotropy assay				ACS Med Chem Lett 11: 34-39 (2020) Article DOI: 10.1021/acsmedchemlett.9b00396
					More data for this Ligand-Target Pair
Galectin-3 (Homo sapiens (Human))	BDBM50509532 (CHEMBL4465115) Show SMILES OC[C@H]1O[C@H](Sc2ccc(Cl)c(Cl)c2)[C@H](O)[C@@H](Nc2cccc(Cl)c2)[C@H]1O |r| Show InChI InChI=1S/C18H18Cl3NO4S/c19-9-2-1-3-10(6-9)22-15-16(24)14(8-23)26-18(17(15)25)27-11-4-5-12(20)13(21)7-11/h1-7,14-18,22-25H,8H2/t14-,15+,16+,17-,18-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	8.10E+4	n/a	n/a	n/a	n/a	n/a
Lund University Curated by ChEMBL					Assay Description Binding affinity at recombinant human Galectin 3 expressed in Escherichia coli BL21 incubated for 5 mins by fluorescence anisotropy assay				ACS Med Chem Lett 11: 34-39 (2020) Article DOI: 10.1021/acsmedchemlett.9b00396
					More data for this Ligand-Target Pair
Galectin-8 (Homo sapiens (Human))	BDBM50509532 (CHEMBL4465115) Show SMILES OC[C@H]1O[C@H](Sc2ccc(Cl)c(Cl)c2)[C@H](O)[C@@H](Nc2cccc(Cl)c2)[C@H]1O |r| Show InChI InChI=1S/C18H18Cl3NO4S/c19-9-2-1-3-10(6-9)22-15-16(24)14(8-23)26-18(17(15)25)27-11-4-5-12(20)13(21)7-11/h1-7,14-18,22-25H,8H2/t14-,15+,16+,17-,18-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	9.60E+4	n/a	n/a	n/a	n/a	n/a
Lund University Curated by ChEMBL					Assay Description Binding affinity at recombinant human C-terminal Galectin 8 expressed in Escherichia coli BL21 incubated for 5 mins by fluorescence anisotropy assay				ACS Med Chem Lett 11: 34-39 (2020) Article DOI: 10.1021/acsmedchemlett.9b00396
					More data for this Ligand-Target Pair
Galectin-1 (Homo sapiens (Human))	BDBM50509532 (CHEMBL4465115) Show SMILES OC[C@H]1O[C@H](Sc2ccc(Cl)c(Cl)c2)[C@H](O)[C@@H](Nc2cccc(Cl)c2)[C@H]1O |r| Show InChI InChI=1S/C18H18Cl3NO4S/c19-9-2-1-3-10(6-9)22-15-16(24)14(8-23)26-18(17(15)25)27-11-4-5-12(20)13(21)7-11/h1-7,14-18,22-25H,8H2/t14-,15+,16+,17-,18-/m1/s1	PDB MMDB NCI pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	4.60E+4	n/a	n/a	n/a	n/a	n/a
Lund University Curated by ChEMBL					Assay Description Binding affinity at recombinant human Galectin 1 expressed in Escherichia coli BL21 incubated for 5 mins by fluorescence anisotropy assay				ACS Med Chem Lett 11: 34-39 (2020) Article DOI: 10.1021/acsmedchemlett.9b00396
					More data for this Ligand-Target Pair