BDBM50527817 CHEMBL4466441

SMILES: CC[C@H](C)[C@@H]1NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCNC1=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](C)N)[C@@H](C)O

InChI Key: InChIKey=NFLXEDORQYAMLZ-VADOWIHESA-N

Data: 1 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 1 hit for monomerid = 50527817   

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
L-lactate dehydrogenase B chain (Homo sapiens (Human))	BDBM50527817 (CHEMBL4466441) Show SMILES CC[C@H](C)[C@@H]1NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCNC1=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](C)N)[C@@H](C)O |r| Show InChI InChI=1S/C42H76N10O11/c1-9-24(6)33-41(62)45-19-13-11-15-28(37(58)49-31(21-23(4)5)40(61)51-33)46-38(59)29(16-17-32(54)55)48-36(57)27(14-10-12-18-43)47-39(60)30(20-22(2)3)50-42(63)34(26(8)53)52-35(56)25(7)44/h22-31,33-34,53H,9-21,43-44H2,1-8H3,(H,45,62)(H,46,59)(H,47,60)(H,48,57)(H,49,58)(H,50,63)(H,51,61)(H,52,56)(H,54,55)/t24-,25-,26+,27-,28-,29-,30-,31-,33-,34-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	KEGG PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	>1.00E+6	n/a	n/a	n/a	n/a	n/a
Universit£ Catholique de Louvain (UCLouvain) Curated by ChEMBL					Assay Description Binding affinity to truncated human N-terminal His6-tagged LDH-H expressed in Escherichia coli Rosetta (DE3) after 5 mins by Red-NHS fluorescence dye...				J Med Chem 63: 4628-4643 (2020) Article DOI: 10.1021/acs.jmedchem.9b01955
					More data for this Ligand-Target Pair