Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 4/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | BRCA1 | P38398 | 1/20 | 0.36 |
| ▸ | RECQL | P46063 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | PPM1D | O15297 | 1/20 | 0.36 |
| ▸ | ESR1 | P03372 | 2/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.34 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL7296751 | 0.83 | CYP2C19 (0.40) | CYP19A1CYP2C19CYP3A4MEN1LMNA | |
| SCHEMBL1115367 | 0.81 | CYP2C19 (0.36) | CYP19A1CYP2C19CYP3A4MEN1LMNA | |
| SCHEMBL1115659 | 0.81 | CYP2C19 (0.36) | CYP19A1CYP2C19CYP3A4MEN1LMNA | |
| SCHEMBL7288543 | 0.77 | PPM1D (0.35) | PPM1D | |
| SCHEMBL7296339 | 0.77 | ESR1 (0.39) | CYP19A1CYP2C19CYP3A4LMNAESR1 | |
| SCHEMBL4340290 | 0.77 | ESR1 (0.39) | CYP19A1CYP2C19CYP3A4LMNAESR1 | |
| SCHEMBL7295857 | 0.72 | CYP2C19 (0.45) | CYP19A1CYP2C19CYP3A4MEN1LMNA | |
| SCHEMBL7298622 | 0.72 | CYP2C19 (0.45) | CYP19A1CYP2C19CYP3A4MEN1LMNA | |
| SCHEMBL2792437 | 0.72 | PPM1D (0.31) | PPM1D | |
| SCHEMBL3118663 | 0.71 | GABRA1 (0.49) | CYP2C19CYP3A4MEN1LMNAMAPK1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0825197-B1 | New 6-hydroxy and 6-oxo-androstane derivatives active on the cardiovascular system and pharmaceutical compositions containing same | SIGMA TAU IND FARMACEUTI (IT) | 2000-10-04 | — | — | EP | disclosed |
| US-5914324-A | HYPOTENSIVE AGENTS, TREATMENT OF CARDIAC FAILURE | SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A. (IT) | 1999-06-22 | — | — | US | disclosed |
| EP-0825197-A2 | New 6-hydroxy and 6-oxo-anstro-stane derivatives active on the cardiovascular system and pharmaceutical compositions containing same | Sigma-Tau Industrie Farmaceutiche Riunite S.p.A. (IT) | 1998-02-25 | — | — | EP | disclosed |