BDBM86134 LDHA Inhibitor, 30

SMILES: Cc1nc2ccc(NC(=O)CCNC(=O)NCCc3ccc(OC(C(O)=O)C(O)=O)cc3)cc2s1

InChI Key: InChIKey=FKUWEZQWIUGSHV-UHFFFAOYSA-N

Data: 1 IC50  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 2 hits for monomerid = 86134   

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 A (Rattus norvegicus (Rat))	BDBM86134 (LDHA Inhibitor, 30) Show SMILES Cc1nc2ccc(NC(=O)CCNC(=O)NCCc3ccc(OC(C(O)=O)C(O)=O)cc3)cc2s1 Show InChI InChI=1S/C23H24N4O7S/c1-13-26-17-7-4-15(12-18(17)35-13)27-19(28)9-11-25-23(33)24-10-8-14-2-5-16(6-3-14)34-20(21(29)30)22(31)32/h2-7,12,20H,8-11H2,1H3,(H,27,28)(H,29,30)(H,31,32)(H2,24,25,33)	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.95E+4	n/a	n/a	n/a	n/a	7.5	21
AstraZeneca					Assay Description Enzyme assay using lactate dehydrogenase A (LDHA).				J Med Chem 55: 3285-306 (2012) Article DOI: 10.1021/jm201734r BindingDB Entry DOI: 10.7270/Q21J9896
					More data for this Ligand-Target Pair
L-lactate dehydrogenase A (Rattus norvegicus (Rat))	BDBM86134 (LDHA Inhibitor, 30) Show SMILES Cc1nc2ccc(NC(=O)CCNC(=O)NCCc3ccc(OC(C(O)=O)C(O)=O)cc3)cc2s1 Show InChI InChI=1S/C23H24N4O7S/c1-13-26-17-7-4-15(12-18(17)35-13)27-19(28)9-11-25-23(33)24-10-8-14-2-5-16(6-3-14)34-20(21(29)30)22(31)32/h2-7,12,20H,8-11H2,1H3,(H,27,28)(H,29,30)(H,31,32)(H2,24,25,33)	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	1.20E+3	n/a	n/a	n/a	7.4	n/a
AstraZeneca					Assay Description A BIAcore 3000 or a BIAcore S51 instrument (GE Healthcare) was used to detect binding interactions using a direct binding assay format.				J Med Chem 55: 3285-306 (2012) Article DOI: 10.1021/jm201734r BindingDB Entry DOI: 10.7270/Q21J9896
					More data for this Ligand-Target Pair