Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | CASP7 | P55210 | 1/20 | 0.32 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | ALOX5 | P09917 | 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 | |
|---|---|---|---|---|
| SCHEMBL9425401 | 0.90 | MAPT (0.30) | ALOX5 | |
| SCHEMBL8946076 | 0.87 | TDP1 (0.35) | ALDH1A1ALOX15ALOX5 | |
| SCHEMBL8946111 | 0.86 | CYP3A4 (0.39) | ALDH1A1ALOX15ALOX5 | |
| SCHEMBL8946080 | 0.85 | MEN1 (0.32) | ALOX5 | |
| Hydrochloric Acid SCHEMBL8946071 | 0.85 | CYP3A4 (0.38) | ALDH1A1ALOX15 | |
| SCHEMBL8946168 | 0.85 | SLC6A2 (0.40) | ALOX5 | |
| SCHEMBL8946175 | 0.82 | MEN1 (0.34) | ALDH1A1 | |
| SCHEMBL8946001 | 0.81 | ALDH1A1 (0.34) | ALDH1A1HSD17B10 | |
| SCHEMBL8946017 | 0.81 | ALOX5 (0.33) | ALDH1A1ALOX5 | |
| SCHEMBL8945875 | 0.81 | CYP2D6 (0.32) | CYP1A2ALOX15HIF1A |
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 |
|---|---|---|---|---|---|---|---|
| US-5510346-A | ANTIDEPRESSANTS, ANTIANXIETY AGENTS | HOECHST MARION ROUSSEL, INC. (US) | 1996-04-23 | — | — | US | disclosed |
| US-5292760-A | 4-heteroaryl-1,3-benzodiazepines and 2-substituted-α-(heteroaryl)benzeneethanamines | HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) | 1994-03-08 | — | — | US | disclosed |