BDBM50409927 CHEMBL2112315
SMILES: CCOC(=O)\C=C\C1(CC1)[C@H](O)\C=C\[C@@H](C)[C@H]1CC[C@H]2\C(CCC[C@]12C)=C\C=C1\C[C@@H](O)C[C@H](O)C1=C
InChI Key: InChIKey=FUDAEUIGIJZUAY-UMIRZPQISA-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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Vitamin D3 receptor A (Danio rerio) | BDBM50409927 (CHEMBL2112315) | PDB UniProtKB/SwissProt GoogleScholar AffyNet | Purchase CHEMBL MCE PC cid PC sid UniChem Similars | PubMed | n/a | n/a | n/a | >3.00E+4 | n/a | n/a | n/a | n/a | n/a |
Institut de G£n£tique et de Biologie Mol£culaire et Cellulaire (IGBMC) Curated by ChEMBL | Assay Description Binding affinity to zebrafish VDR LBD assessed as Kd for fluorescein-labeled SRC1 NR2 peptide binding by micro-scale thermophoresis method | J Med Chem 63: 9457-9463 (2020) | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Vitamin D3 receptor (Homo sapiens (Human)) | BDBM50409927 (CHEMBL2112315) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | Purchase CHEMBL MCE PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | n/a | n/a | 0.350 | n/a | n/a | n/a | n/a |
INSERM Curated by ChEMBL | Assay Description Effective concentration required for inhibition of Vitamin D3 receptor | J Med Chem 47: 1956-61 (2004) Article DOI: 10.1021/jm0310582 BindingDB Entry DOI: 10.7270/Q2Q81CHJ | |||||||||||
More data for this Ligand-Target Pair |