HOME LIGAND hPROTEOME OTHERS DOCUMENT

P17931 | LEG3_HUMAN | Galectin-3 (LGALS3)

3D structures mapped by conservation among orthologs

[ Domain: "Concanavalin A-like lectins/glucanases" // Gal-bind_lectin ]

download pymol session

[ Domain: pdbs with more than 2 multi-domains ]

download pymol session



[ Alpha Fold Model ] (go)


Known binders annotated in ChEMBL

IC50 table

molecule_chembl_id structure assay_type relation values units mol_wt smiles organism assay_chembl_id bao_label
CHEMBL4779606 OBDepict OH H O H OH H H N N O H O N H 3 C H 3 C N S F N Cl Cl IC50 = 14.0 nM 582.44 CO[C@@H]1[C@@H](n2cc(-c3ccc(Cl)c(Cl)c3F)nn2)[C@@H](O)[C@@H](CO)O[C@H]1C(=O)N(C)c1ccc2ncsc2c1 Homo sapiens CHEMBL4679827 single protein format
CHEMBL4791572 OBDepict OH H O H OH H H N N O H O N H 3 C H 3 C N S Cl N F Cl IC50 = 18.0 nM 582.44 CO[C@@H]1[C@@H](n2cc(-c3ccc(Cl)c(F)c3Cl)nn2)[C@@H](O)[C@@H](CO)O[C@H]1C(=O)N(C)c1ccc2ncsc2c1 Homo sapiens CHEMBL4679827 single protein format
CHEMBL4754458 OBDepict OH H O H OH H H N N O H O N H 3 C H 3 C N S F N F Cl IC50 = 21.0 nM 565.99 CO[C@@H]1[C@@H](n2cc(-c3ccc(Cl)c(F)c3F)nn2)[C@@H](O)[C@@H](CO)O[C@H]1C(=O)N(C)c1ccc2ncsc2c1 Homo sapiens CHEMBL4679827 single protein format
CHEMBL4741028 OBDepict OH H O H OH H H N N O H O N H 3 C H 3 C N S N F F F IC50 = 22.0 nM 549.53 CO[C@@H]1[C@@H](n2cc(-c3cc(F)c(F)c(F)c3)nn2)[C@@H](O)[C@@H](CO)O[C@H]1C(=O)N(C)c1ccc2ncsc2c1 Homo sapiens CHEMBL4679827 single protein format