Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 7/20 | 0.67 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.58 |
| ▸ | STS | P08842 | 8/20 | 0.55 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.53 |
| ▸ | LMNA | P02545 | 3/20 | 0.52 |
| ▸ | MAPT | P10636 | 3/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.52 |
| ▸ | PGR | P06401 | 2/20 | 0.52 |
| ▸ | AR | P10275 | 2/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.52 |
| ▸ | POLB | P06746 | 1/20 | 0.52 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.52 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.52 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.52 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.52 |
| ▸ | ATM | Q13315 | 1/20 | 0.52 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | USP2 | O75604 | 1/20 | 0.52 |
| ▸ | TP53 | P04637 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL5707483 | 0.96 | ESR1 (0.69) | ESR1ESR2STSAKR1C3LMNA | |
| SCHEMBL5707489 | 0.93 | ESR1 (0.73) | ESR1ESR2STSAKR1C3LMNA | |
| SCHEMBL5707720 | 0.88 | STS (0.66) | ESR1ESR2STS | |
| SCHEMBL5707717 | 0.88 | STS (0.66) | ESR1ESR2STS | |
| SCHEMBL7099459 | 0.88 | STS (0.66) | ESR1ESR2STS | |
| SCHEMBL5707423 | 0.87 | STS (0.67) | ESR1ESR2STS | |
| SCHEMBL5707427 | 0.87 | STS (0.67) | ESR1ESR2STS | |
| SCHEMBL7100500 | 0.87 | ESR1 (0.54) | ESR1ESR2STSAKR1C3 | |
| SCHEMBL7882395 | 0.87 | ESR1 (0.51) | ESR1ESR2STSAKR1C3 | |
| SCHEMBL5707521 | 0.87 | ESR1 (0.59) | ESR1ESR2STSAKR1C3LMNA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1009755-B1 | STEROID SULFATASE INHIBITORS AND METHODS FOR MAKING AND USING THE SAME | UNIV HOLY GHOST DUQUESNE (US) | 2003-09-17 | — | — | EP | disclosed |
| US-5880115-A | Steroid sulfatase inhibitors and methods for making and using the same | DUQUESNE UNIVERSITY OF THE HOLY GHOST (US) | 1999-03-09 | — | — | US | disclosed |