BDBM29688 3-(9-(3-chloro-4-{[(4-methylphenyl)sulfonyl]oxy}phenyl)-1,8-dioxo-2,3,4,5,6,7,8,9-octahydro-10(1H)-acridinyl)propanoic acid::3-[9-(3-chloro-4-tosyloxy-phenyl)-1,8-diketo-3,4,5,6,7,9-hexahydro-2H-acridin-10-yl]propionic acid::3-[9-[3-chloranyl-4-(4-methylphenyl)sulfonyloxy-phenyl]-1,8-bis(oxidanylidene)-3,4,5,6,7,9-hexahydro-2H-acridin-10-yl]propanoic acid::3-[9-[3-chloro-4-(4-methylphenyl)sulfonyloxyphenyl]-1,8-dioxo-3,4,5,6,7,9-hexahydro-2H-acridin-10-yl]propanoic acid::MLS000704358::SMR000230917::cid_1770167

SMILES: Cc1ccc(cc1)S(=O)(=O)Oc1ccc(cc1Cl)C1C2=C(CCCC2=O)N(CCC(O)=O)C2=C1C(=O)CCC2

InChI Key: InChIKey=UWVGIRKZUFFCOL-UHFFFAOYSA-N

Data: 2 IC50

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 = 29688   

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
Runt-Related Transcription Factor 1 Isoform AML1C (Homo sapiens (Human))	BDBM29688 (3-(9-(3-chloro-4-{[(4-methylphenyl)sulfonyl]oxy}ph...) Show SMILES Cc1ccc(cc1)S(=O)(=O)Oc1ccc(cc1Cl)C1C2=C(CCCC2=O)N(CCC(O)=O)C2=C1C(=O)CCC2 |c:35,t:21| Show InChI InChI=1S/C29H28ClNO7S/c1-17-8-11-19(12-9-17)39(36,37)38-25-13-10-18(16-20(25)30)27-28-21(4-2-6-23(28)32)31(15-14-26(34)35)22-5-3-7-24(33)29(22)27/h8-13,16,27H,2-7,14-15H2,1H3,(H,34,35)	PDB MMDB NCI pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	1.46E+4	n/a	n/a	n/a	n/a	7.4	23
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description This assay is to use HTS to identify inhibitors of the protein-protein interaction between the RUNX1 Runt domain and CBFbeta-SMMHC, a potential thera...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2DV1H7P
					More data for this Ligand-Target Pair
Runt-Related Transcription Factor 1 Isoform AML1C (Homo sapiens (Human))	BDBM29688 (3-(9-(3-chloro-4-{[(4-methylphenyl)sulfonyl]oxy}ph...) Show SMILES Cc1ccc(cc1)S(=O)(=O)Oc1ccc(cc1Cl)C1C2=C(CCCC2=O)N(CCC(O)=O)C2=C1C(=O)CCC2 |c:35,t:21| Show InChI InChI=1S/C29H28ClNO7S/c1-17-8-11-19(12-9-17)39(36,37)38-25-13-10-18(16-20(25)30)27-28-21(4-2-6-23(28)32)31(15-14-26(34)35)22-5-3-7-24(33)29(22)27/h8-13,16,27H,2-7,14-15H2,1H3,(H,34,35)	PDB MMDB NCI pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	1.46E+4	n/a	n/a	n/a	n/a	7.4	23
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description This assay is to identify inhibitors of the protein-protein interaction between the RUNX1 Runt domain and CBFbeta-SMMHC. This is accomplished by usin...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2T72FSX
					More data for this Ligand-Target Pair