BDBM50034157 CHEMBL276320::N-Phenyl-N-((4aR,6aS,7S,11aR)-1,4a,6a-trimethyl-2-oxo-hexadecahydro-indeno[5,4-f]quinolin-7-yl)-benzamide
SMILES: CN1[C@@H]2CCC3C4CC[C@H](N(C(=O)c5ccccc5)c5ccccc5)[C@@]4(C)CCC3[C@@]2(C)CCC1=O
InChI Key: InChIKey=FGXXHFWGZTYOIF-NDEMJMHESA-N
Data: 2 IC50
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
5α-Reductase 1 (5α-R1) (Homo sapiens (Human)) | BDBM50034157 (CHEMBL276320 | N-Phenyl-N-((4aR,6aS,7S,11aR)-1,4a,...) | UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | n/a | n/a | 2.90 | n/a | n/a | n/a | n/a | n/a | n/a |
CHUL Research Center Curated by ChEMBL | Assay Description In vitro inhibition of human steroid 5-alpha-reductase type I in Du-145 cells | J Med Chem 38: 1158-73 (1995) BindingDB Entry DOI: 10.7270/Q2NG4R90 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Steroid 5-alpha-reductase (Homo sapiens (Human)) | BDBM50034157 (CHEMBL276320 | N-Phenyl-N-((4aR,6aS,7S,11aR)-1,4a,...) | PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | n/a | n/a | 3.80 | n/a | n/a | n/a | n/a | n/a | n/a |
CHUL Research Center Curated by ChEMBL | Assay Description In vitro inhibition of human steroid 5-alpha-reductase type 2 in SW-13-transfected cells | J Med Chem 38: 1158-73 (1995) BindingDB Entry DOI: 10.7270/Q2NG4R90 | |||||||||||
More data for this Ligand-Target Pair |