Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 528.8 BDBM488023

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 1 hit in this display   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Mucosa-associated lymphoid tissue lymphoma translocation protein 1 (Homo sapiens (Human))	BDBM488023 ((*S)-N-(5-chloro-6-(2H-1,2,3- triazol-2-yl)pyridin...) Show SMILES C[C@H](O)c1nccc2c(cccc12)-n1ncc(C(=O)Nc2cnc(c(Cl)c2)-n2nccn2)c1C(F)(F)F |r| Show InChI InChI=1S/C23H16ClF3N8O2/c1-12(36)19-15-3-2-4-18(14(15)5-6-28-19)34-20(23(25,26)27)16(11-32-34)22(37)33-13-9-17(24)21(29-10-13)35-30-7-8-31-35/h2-12,36H,1H3,(H,33,37)/t12-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	79	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Pharmaceutica NV US Patent					Assay Description MALT1 protease activity was assessed in an in vitro assay using a tetrapeptide as substrate and full-length MALT1 protein (Strep-MALT1(1-824)-His) pu...				US Patent US10954214 (2021) BindingDB Entry DOI: 10.7270/Q2SX6HB1
					More data for this Ligand-Target Pair