BDBM50144435 1-methyl-5-[2'-oxospiro[cyclohexane-1,3'-(2',3'-dihydro-1'H-indole)]-5-yl]-1H-2-pyrrolecarbonitrile::5-(spiro[cyclohexane-1,3'-[3H]indole]-2'-oxo-5'-yl)-1H-pyrrole-1-methyl-2-carbonitrile::CHEMBL305298
SMILES: Cn1c(ccc1-c1ccc2NC(=O)C3(CCCCC3)c2c1)C#N
InChI Key: InChIKey=WMIPEGGWIZEEMY-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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Progesterone receptor (Homo sapiens (Human)) | BDBM50144435 (1-methyl-5-[2'-oxospiro[cyclohexane-1,3'-(2',3'-di...) | PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | Article PubMed | n/a | n/a | >3.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Research Curated by ChEMBL | Assay Description Ability to block progesterone induced alkaline phosphatase activity in T47D human breast cancer cell line | Bioorg Med Chem Lett 14: 2185-9 (2004) Article DOI: 10.1016/j.bmcl.2004.02.054 BindingDB Entry DOI: 10.7270/Q2X34Z1K | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Progesterone receptor (Homo sapiens (Human)) | BDBM50144435 (1-methyl-5-[2'-oxospiro[cyclohexane-1,3'-(2',3'-di...) | PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | Article PubMed | n/a | n/a | n/a | n/a | 2.30 | n/a | n/a | n/a | n/a |
Wyeth Research Curated by ChEMBL | Assay Description Agonist activity at human PR expressed in human T47D cells assessed as stimulation of alkaline phosphatase | J Med Chem 51: 1861-73 (2008) Article DOI: 10.1021/jm701080t BindingDB Entry DOI: 10.7270/Q2G44R56 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Progesterone receptor (Homo sapiens (Human)) | BDBM50144435 (1-methyl-5-[2'-oxospiro[cyclohexane-1,3'-(2',3'-di...) | PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | Article PubMed | n/a | n/a | 3.30 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Research Curated by ChEMBL | Assay Description Displacement of [3H]R5020 from human PR in human T47D cells by whole cell assay | J Med Chem 51: 1861-73 (2008) Article DOI: 10.1021/jm701080t BindingDB Entry DOI: 10.7270/Q2G44R56 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Progesterone receptor (Homo sapiens (Human)) | BDBM50144435 (1-methyl-5-[2'-oxospiro[cyclohexane-1,3'-(2',3'-di...) | PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | Article PubMed | n/a | n/a | n/a | n/a | 2.80 | n/a | n/a | n/a | n/a |
Wyeth Research Curated by ChEMBL | Assay Description Agonistic activity measures the ability to induce alkaline phosphatase in T47D human breast cancer cell line | Bioorg Med Chem Lett 14: 2185-9 (2004) Article DOI: 10.1016/j.bmcl.2004.02.054 BindingDB Entry DOI: 10.7270/Q2X34Z1K | |||||||||||
More data for this Ligand-Target Pair |