BDBM50107178 5-[3-(4-Acetyl-piperazin-1-yl)-3-oxo-propenyl]-2-(2,3-dichloro-phenylsulfanyl)-N,N-dimethyl-benzenesulfonamide::CHEMBL137961
SMILES: CN(C)S(=O)(=O)c1cc(\C=C\C(=O)N2CCN(CC2)C(C)=O)ccc1Sc1cccc(Cl)c1Cl
InChI Key: InChIKey=NTMNREATHFIDFG-CSKARUKUSA-N
Data: 1 IC50
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 |
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Integrin alpha-L (Homo sapiens (Human)) | BDBM50107178![]() (5-[3-(4-Acetyl-piperazin-1-yl)-3-oxo-propenyl]-2-(...) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![]() | CHEMBL PC cid PC sid UniChem | PubMed | n/a | n/a | 3.75E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories Curated by ChEMBL | Assay Description Inhibition of intercellular adhesion molecule-1 (ICAM-1) binding to recombinant LFA-1, range(3700-3800) | J Med Chem 44: 4393-403 (2001) BindingDB Entry DOI: 10.7270/Q2WW7GZN | |||||||||||
More data for this Ligand-Target Pair |