Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | GLI1 | P08151 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 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 | |
|---|---|---|---|---|
| SCHEMBL8732979 | 0.86 | SLC6A4 (0.34) | ALDH1A1GLI1CYP3A4CYP2D6 | |
| SCHEMBL9069877 | 0.83 | ALDH1A1 (0.30) | ALDH1A1GLI1CYP3A4CYP2D6 | |
| SCHEMBL31112181 | 0.78 | ALDH1A1 (0.40) | ALDH1A1GLI1CYP3A4CYP2D6 | |
| SCHEMBL6904054 | 0.78 | ALDH1A1 (0.40) | ALDH1A1GLI1CYP3A4CYP2D6 | |
| Bromide SCHEMBL10478363 | 0.76 | AR (0.39) | ALDH1A1GLI1CYP3A4CYP2D6 | |
| SCHEMBL6913354 | 0.76 | AR (0.39) | ALDH1A1GLI1CYP3A4CYP2D6 | |
| SCHEMBL8732971 | 0.70 | ALDH1A1 (0.31) | ALDH1A1GLI1CYP3A4CYP2D6 | |
| SCHEMBL140407 | 0.68 | CTSD (0.35) | — | |
| Phenol SCHEMBL5275829 | 0.66 | CA12 (0.42) | ALDH1A1CYP3A4 | |
| Hydrochloric Acid SCHEMBL3667602 | 0.66 | CTSD (0.33) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0632819-B1 | ADDITION POLYMERIZATION CATALYSTS COMPRISING REDUCED OXIDATION STATE METAL COMPLEXES | DOW CHEMICAL CO (US) | 1998-09-02 | — | — | EP | disclosed |
| US-5532394-A | CONTAINING TITANIUM, DIVALENT MOIETY, LINKING GROUP, MONOVALENT ANIONIC STABILIZING GROUP | THE DOW CHEMICAL COMPANY (US) | 1996-07-02 | — | — | US | disclosed |
| EP-0632819-A1 | ADDITION POLYMERIZATION CATALYSTS COMPRISING REDUCED OXIDATION STATE METAL COMPLEXES | THE DOW CHEMICAL COMPANY (US) | 1995-01-11 | — | — | EP | disclosed |
| WO-1993019104-A1 | ADDITION POLYMERIZATION CATALYSTS COMPRISING REDUCED OXIDATION STATE METAL COMPLEXES | THE DOW CHEMICAL COMPANY (US) | 1993-09-30 | — | — | WO | disclosed |