null
SMILES: CC(C)OC(=O)CNP(=O)(CC\C=C(/C)CO)Oc1ccccc1
InChI Key: InChIKey=VSHIPDCBCPUGHS-OVCLIPMQSA-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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Butyrophilin subfamily 3 member A1 (Homo sapiens (Human)) | BDBM50459339 (CHEMBL4204584) | PDB UniProtKB/SwissProt GoogleScholar AffyNet | PC cid PC sid UniChem | Article PubMed | n/a | n/a | n/a | n/a | 740 | n/a | n/a | n/a | n/a |
University of Iowa Curated by ChEMBL | Assay Description Binding affinity to BTN3A1 in human Vgamma9 Vdelta2 T cells mixed with human K562 cells pretreated with compound for 4 hrs assessed as INF-gamma prod... | J Med Chem 61: 8658-8669 (2018) Article DOI: 10.1021/acs.jmedchem.8b00655 BindingDB Entry DOI: 10.7270/Q2CZ39RD | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Butyrophilin subfamily 3 member A1 (Homo sapiens (Human)) | BDBM50459339 (CHEMBL4204584) | PDB UniProtKB/SwissProt GoogleScholar AffyNet | PC cid PC sid UniChem | Article PubMed | n/a | n/a | n/a | n/a | 1.10 | n/a | n/a | n/a | n/a |
University of Iowa Curated by ChEMBL | Assay Description Binding affinity to BTN3A1 in human PBMC assessed as stimulation of Vgamma9 Vdelta2 T cells incubated for 3 days and measured after 11 days post comp... | J Med Chem 61: 8658-8669 (2018) Article DOI: 10.1021/acs.jmedchem.8b00655 BindingDB Entry DOI: 10.7270/Q2CZ39RD | |||||||||||
More data for this Ligand-Target Pair |