Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.56 |
| ▸ | LMNA | P02545 | 1/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.56 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.55 |
| ▸ | MAPT | P10636 | 3/20 | 0.55 |
| ▸ | HTT | P42858 | 1/20 | 0.54 |
| ▸ | CA1 | P00915 | 1/20 | 0.53 |
| ▸ | CA2 | P00918 | 1/20 | 0.53 |
| ▸ | CA7 | P43166 | 1/20 | 0.53 |
| ▸ | CA9 | Q16790 | 1/20 | 0.53 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.51 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | PKM | P14618 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL8869423 | 0.92 | ALDH1A1 (0.57) | ALDH1A1LMNASMN1; SMN2MAPK1MAPT | |
| SCHEMBL8868897 | 0.92 | ALDH1A1 (0.56) | ALDH1A1LMNASMN1; SMN2MAPK1MAPT | |
| SCHEMBL9137194 | 0.91 | CA1 (0.62) | ALDH1A1LMNASMN1; SMN2MAPK1MAPT | |
| SCHEMBL9141664 | 0.89 | CA1 (0.55) | ALDH1A1SMN1; SMN2MAPTCA1CA2 | |
| SCHEMBL9141400 | 0.89 | RAB9A (0.54) | ALDH1A1SMN1; SMN2MAPTHTTNPC1 | |
| SCHEMBL9139759 | 0.88 | NPC1 (0.46) | ALDH1A1SMN1; SMN2MAPTNPC1RAB9A | |
| SCHEMBL9140238 | 0.88 | PPARA (0.49) | ALDH1A1LMNASMN1; SMN2MAPTHTT | |
| SCHEMBL9139197 | 0.87 | POLB (0.50) | ALDH1A1MAPTGAARAB9AKMT2A | |
| SCHEMBL9138817 | 0.87 | P4HTM (0.52) | ALDH1A1LMNASMN1; SMN2MAPTCA1 | |
| SCHEMBL9018568 | 0.87 | ALDH1A1 (0.54) | ALDH1A1LMNASMN1; SMN2MAPK1MAPT |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5428046-A | Antifibrotic agents | HOECHST AKTIENGESELLSCHAFT (DE) | 1995-06-27 | — | — | US | disclosed |