Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.34 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL8889111 | 0.83 | CYP1A2 (0.43) | CYP1A2TSHRALDH1A1CYP3A4HPGD | |
| SCHEMBL30674801 | 0.76 | CYP1A2 (0.53) | CYP1A2TSHRALDH1A1CYP3A4HPGD | |
| SCHEMBL601246 | 0.76 | CYP1A2 (0.53) | CYP1A2TSHRALDH1A1CYP3A4HPGD | |
| SCHEMBL31001023 | 0.73 | CYP1A2 (0.56) | CYP1A2TSHRALDH1A1CYP3A4HPGD | |
| SCHEMBL5250464 | 0.72 | TSHR (0.48) | CYP1A2TSHRALDH1A1CYP3A4HPGD | |
| SCHEMBL5399249 | 0.72 | ADORA3 (0.32) | ADORA3 | |
| SCHEMBL19011753 | 0.69 | ACHE (0.39) | CYP1A2ALDH1A1CYP3A4HPGDHSD17B10 | |
| SCHEMBL598994 | 0.68 | CYP1A2 (0.39) | CYP1A2TSHRALDH1A1CYP3A4HPGD | |
| SCHEMBL4078654 | 0.67 | TSHR (0.38) | CYP1A2TSHRALDH1A1CYP3A4TDP1 | |
| SCHEMBL10434554 | 0.67 | CYP1A2 (0.58) | CYP1A2TSHRALDH1A1CYP3A4HPGD |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6365762-B1 | IN THE PRESENCE OF A RHENIUM CONTAINING CATALYST | AVENTIS RESEARCH & TECHNOLOGIES GMBH & CO. KG (DE) | 2002-04-02 | — | — | US | disclosed |
| EP-0665209-B1 | Process for the catalytic oxidation of aromatic compounds | HOECHST AG (DE) | 1998-12-02 | — | — | EP | disclosed |
| US-5710292-A | RHENIUM CATALYSTS | HOECHST AKTIENGESELLSCHAFT (DE) | 1998-01-20 | — | — | US | disclosed |
| EP-0686618-B1 | Process for the selective oxidation of aromatic compounds | HOECHST AG (DE) | 1998-01-14 | — | — | EP | disclosed |
| US-5616734-A | OXIDIZING AROMATIC RING OF ELECTRON-RICH COMPOUNDS IN PRESENCE OF OXYGEN-CONTAINING ORGANIC RHENIUM CATALYST AND PEROXIDE-CONTAINING COMPOUND | HOECHST AKTIENGESELLSCHAFT (DE) | 1997-04-01 | — | — | US | disclosed |
| EP-0686618-A1 | Process for the selective oxidation of aromatic compounds | HOECHST AKTIENGESELLSCHAFT (DE) | 1995-12-13 | — | — | EP | disclosed |
| EP-0665209-A1 | Process for the catalytic oxidation of aromatic compounds | HOECHST AKTIENGESELLSCHAFT (DE) | 1995-08-02 | — | — | EP | disclosed |