Ligand

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Ligand Name:   3-AMINOPYRIDINE-4-CARBOXYLIC ACID
HET ID:   4SV PubChem:   459531
DrugBank:   - ChEMBL:   CHEMBL1383671
Canonical SMILES:   OC(=O)c1ccncc1N
Standard InChI:   InChI=1S/C6H6N2O2/c7-5-3-8-2-1-4(5)6(9)10/h1-3H,7H2,(H,9,10)
Molecular Formula:   C6H6N2O2 Mol. Weight:   138.12404 Heavy Atoms:   10
Charge:   0 Is Chiral:   False logP:   0.9432
HBD:   2 HBA:   4 TPSA:   76.21
#Bonds:   10 #Rotatable Bonds:   1 Shape Complexity:   0.0
Stereocomplexity:   0.0
Bound Proteins
Protein Name Uniprot ID/ACC Organism PDB ID Binding Affinity Binding Database Complex Card
Lysine-specific demethylase 4D Q6B0I6 (KDM4D_HUMAN) Homo sapiens 5FP9 IC50 : 1259.0 nM, IC50 : 1585.0 nM BindingDB SHOW
Lysine-specific demethylase 4D Q6B0I6 (KDM4D_HUMAN) Homo sapiens 5FP9 IC50 : 1585.0 nM Binding MOAD SHOW