BDBM71388 2-[(9,10-diketo-2-anthryl)sulfonylamino]acetic acid::2-[(9,10-dioxo-2-anthracenyl)sulfonylamino]acetic acid::2-[(9,10-dioxoanthracen-2-yl)sulfonylamino]acetic acid::2-[[9,10-bis(oxidanylidene)anthracen-2-yl]sulfonylamino]ethanoic acid::MLS001195924::N-[(9,10-dioxo-9,10-dihydroanthracen-2-yl)sulfonyl]glycine::SMR000558754::cid_7122777
SMILES: OC(=O)CNS(=O)(=O)c1ccc2C(=O)c3ccccc3C(=O)c2c1
InChI Key: InChIKey=DURRDEYKNKAQFB-UHFFFAOYSA-N
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Chemokine CXCL12 (Homo sapiens (Human)) | BDBM71388 (2-[(9,10-diketo-2-anthryl)sulfonylamino]acetic aci...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | Purchase PC cid PC sid UniChem | PubMed | n/a | n/a | n/a | 1.20E+6 | n/a | n/a | n/a | n/a | n/a |
University of South Florida Curated by ChEMBL | Assay Description Binding affinity to His6-SUMO fusion tagged wild type human [U-15N]CXCL12 expressed in Escherichia coli by 2D 1H-15N HMQC NMR spectroscopy | J Med Chem 59: 4342-51 (2016) BindingDB Entry DOI: 10.7270/Q2DB83SC | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
MSRA protein (Bos taurus) | BDBM71388 (2-[(9,10-diketo-2-anthryl)sulfonylamino]acetic aci...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | Purchase PC cid PC sid UniChem | PCBioAssay | n/a | n/a | >1.55E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
The Scripps Research Institute Molecular Screening Center Curated by PubChem BioAssay | PubChem Bioassay (2013) BindingDB Entry DOI: 10.7270/Q2639NCQ | ||||||||||||
More data for this Ligand-Target Pair |