Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SHBG | P04278 | 2/20 | 0.38 |
| ▸ | PGR | P06401 | 1/20 | 0.30 |
| ▸ | MAOA | P21397 | 1/20 | 0.30 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL612009 | 1.00 | SHBG (0.38) | SHBGPGRMAOAOPRK1ALDH1A1 | |
| SCHEMBL9118328 | 1.00 | SHBG (0.38) | SHBGPGRMAOAOPRK1ALDH1A1 | |
| SCHEMBL609535 | 1.00 | SHBG (0.38) | SHBGPGRMAOAOPRK1ALDH1A1 | |
| SCHEMBL609797 | 1.00 | SHBG (0.38) | SHBGPGRMAOAOPRK1ALDH1A1 | |
| SCHEMBL7701721 | 0.81 | L3MBTL1 (0.33) | — | |
| SCHEMBL9119013 | 0.78 | PLA2G1B (0.31) | — | |
| SCHEMBL9114377 | 0.78 | PLA2G1B (0.31) | — | |
| SCHEMBL12231026 | 0.73 | L3MBTL1 (0.30) | — | |
| SCHEMBL612123 | 0.73 | L3MBTL1 (0.30) | — | |
| SCHEMBL50283 | 0.73 | L3MBTL1 (0.33) | ALDH1A1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| US-5446203-A | Synthesis of haloenones and aryl or alkyl substituted enones or alkenes | NEW YORK UNIVERSITY (US) | 1995-08-29 | — | — | US | disclosed |
| EP-0656878-A4 | SYNTHESIS OF HALOENONES AND ARYL OR ALKYL SUBSTITUTED ENONES OR ALKENES. | — | 1995-07-05 | — | — | EP | disclosed |
| EP-0656878-A1 | SYNTHESIS OF HALOENONES AND ARYL OR ALKYL SUBSTITUTED ENONES OR ALKENES | NEW YORK UNIVERSITY (US) | 1995-06-14 | — | — | EP | disclosed |