BDBM50228079 (R)-N-(3-(1-cyclopropyl-1-(4-fluorophenyl)ethyl)-1H-indol-7-yl)methanesulfonamide::CHEMBL235209
SMILES: C[C@](C1CC1)(c1c[nH]c2c(NS(C)(=O)=O)cccc12)c1ccc(F)cc1
InChI Key: InChIKey=MIAURGNSNSBTNK-HXUWFJFHSA-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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Mineralocorticoid receptor (Homo sapiens (Human)) | BDBM50228079 ((R)-N-(3-(1-cyclopropyl-1-(4-fluorophenyl)ethyl)-1...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | Article PubMed | 0.640 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA Curated by ChEMBL | Assay Description Displacement of [3H]methyltrienolone from human mineralocorticoid receptor expressed in HEK293 cells | ACS Med Chem Lett 2: 148-153 (2011) Article DOI: 10.1021/ml100220b BindingDB Entry DOI: 10.7270/Q2Z038G1 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Mineralocorticoid receptor (Homo sapiens (Human)) | BDBM50228079 ((R)-N-(3-(1-cyclopropyl-1-(4-fluorophenyl)ethyl)-1...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | Article PubMed | 1.56 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly Research Laboratories Curated by ChEMBL | Assay Description Binding affinity to human mineralocorticoid receptor | J Med Chem 50: 6443-5 (2007) Article DOI: 10.1021/jm701186z BindingDB Entry DOI: 10.7270/Q23B5ZVP | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Glucocorticoid receptor (Homo sapiens (Human)) | BDBM50228079 ((R)-N-(3-(1-cyclopropyl-1-(4-fluorophenyl)ethyl)-1...) | PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | Article PubMed | 6.39 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA Curated by ChEMBL | Assay Description Displacement of [3H]methyltrienolone from human glucocorticoid receptor expressed in HEK293 cells | ACS Med Chem Lett 2: 148-153 (2011) Article DOI: 10.1021/ml100220b BindingDB Entry DOI: 10.7270/Q2Z038G1 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Progesterone receptor (Homo sapiens (Human)) | BDBM50228079 ((R)-N-(3-(1-cyclopropyl-1-(4-fluorophenyl)ethyl)-1...) | PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | Article PubMed | 137 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly Research Laboratories Curated by ChEMBL | Assay Description Binding affinity to human progesterone receptor | J Med Chem 50: 6443-5 (2007) Article DOI: 10.1021/jm701186z BindingDB Entry DOI: 10.7270/Q23B5ZVP | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Glucocorticoid receptor (Homo sapiens (Human)) | BDBM50228079 ((R)-N-(3-(1-cyclopropyl-1-(4-fluorophenyl)ethyl)-1...) | PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | Article PubMed | 167 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly Research Laboratories Curated by ChEMBL | Assay Description Binding affinity to human glucocorticoid receptor | J Med Chem 50: 6443-5 (2007) Article DOI: 10.1021/jm701186z BindingDB Entry DOI: 10.7270/Q23B5ZVP | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Androgen receptor (Homo sapiens (Human)) | BDBM50228079 ((R)-N-(3-(1-cyclopropyl-1-(4-fluorophenyl)ethyl)-1...) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | Article PubMed | 220 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA Curated by ChEMBL | Assay Description Displacement of [3H]methyltrienolone from human androgen receptor expressed in HEK293 cells | ACS Med Chem Lett 2: 148-153 (2011) Article DOI: 10.1021/ml100220b BindingDB Entry DOI: 10.7270/Q2Z038G1 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Progesterone receptor (Homo sapiens (Human)) | BDBM50228079 ((R)-N-(3-(1-cyclopropyl-1-(4-fluorophenyl)ethyl)-1...) | PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | Article PubMed | 454 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA Curated by ChEMBL | Assay Description Displacement of [3H]methyltrienolone from human progesterone receptor expressed in HEK293 cells | ACS Med Chem Lett 2: 148-153 (2011) Article DOI: 10.1021/ml100220b BindingDB Entry DOI: 10.7270/Q2Z038G1 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Androgen receptor (Homo sapiens (Human)) | BDBM50228079 ((R)-N-(3-(1-cyclopropyl-1-(4-fluorophenyl)ethyl)-1...) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | Article PubMed | 849 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly Research Laboratories Curated by ChEMBL | Assay Description Binding affinity to human androgen receptor | J Med Chem 50: 6443-5 (2007) Article DOI: 10.1021/jm701186z BindingDB Entry DOI: 10.7270/Q23B5ZVP | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Estrogen receptor (Homo sapiens (Human)) | BDBM50228079 ((R)-N-(3-(1-cyclopropyl-1-(4-fluorophenyl)ethyl)-1...) | PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | Article PubMed | >1.10E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly Research Laboratories Curated by ChEMBL | Assay Description Binding affinity to human estrogen receptor | J Med Chem 50: 6443-5 (2007) Article DOI: 10.1021/jm701186z BindingDB Entry DOI: 10.7270/Q23B5ZVP | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Progesterone receptor (Homo sapiens (Human)) | BDBM50228079 ((R)-N-(3-(1-cyclopropyl-1-(4-fluorophenyl)ethyl)-1...) | PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | Article PubMed | n/a | n/a | 765 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA Curated by ChEMBL | Assay Description Antagonist activity at human progesterone receptor expressed in HEK293 cells assessed as inhibition of R5050-induced transcriptional activity by GRE-... | ACS Med Chem Lett 2: 148-153 (2011) Article DOI: 10.1021/ml100220b BindingDB Entry DOI: 10.7270/Q2Z038G1 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Mineralocorticoid receptor (Homo sapiens (Human)) | BDBM50228079 ((R)-N-(3-(1-cyclopropyl-1-(4-fluorophenyl)ethyl)-1...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | Article PubMed | n/a | n/a | 64.1 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA Curated by ChEMBL | Assay Description Antagonist activity at human mineralocorticoid receptor expressed in HEK293 cells assessed as inhibition of R5050-induced transcriptional activity by... | ACS Med Chem Lett 2: 148-153 (2011) Article DOI: 10.1021/ml100220b BindingDB Entry DOI: 10.7270/Q2Z038G1 | |||||||||||
More data for this Ligand-Target Pair |