Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | CTSC | P53634 | 3/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL10468840 | 1.00 | ALDH1A1 (0.40) | ALDH1A1CTSCKDM4EHSD17B10CYP1A2 | |
| SCHEMBL10468498 | 0.98 | ALDH1A1 (0.38) | ALDH1A1CTSCKDM4EHSD17B10CYP1A2 | |
| SCHEMBL25232302 | 0.95 | CYP2D6 (0.36) | ALDH1A1CTSCKDM4EHSD17B10CYP1A2 | |
| SCHEMBL30753324 | 0.92 | KDM4E (0.37) | ALDH1A1CTSCKDM4EHSD17B10CYP1A2 | |
| SCHEMBL1440880 | 0.87 | KDM4E (0.33) | ALDH1A1KDM4EHSD17B10CYP1A2CYP2D6 | |
| SCHEMBL1440620 | 0.85 | TSHR (0.35) | ALDH1A1KDM4EHSD17B10CYP1A2CYP2D6 | |
| SCHEMBL24021029 | 0.85 | KDM4E (0.34) | ALDH1A1CTSCKDM4EHSD17B10CYP1A2 | |
| SCHEMBL1441645 | 0.85 | KDM4E (0.34) | ALDH1A1CTSCKDM4EHSD17B10CYP1A2 | |
| SCHEMBL12820211 | 0.84 | KDM4E (0.36) | ALDH1A1KDM4EHSD17B10CYP1A2CYP2D6 | |
| SCHEMBL23824307 | 0.82 | BACE1 (0.42) | ALDH1A1CTSCKDM4EHSD17B10CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0268975-B1 | Process for the preparation of mono, bi and tricyclic amino acids, intermediary compounds and their preparation | HOECHST AG (DE) | 1994-05-25 | — | — | EP | disclosed |
| EP-0268975-A2 | Process for the preparation of mono, bi and tricyclic amino acids, intermediary compounds and their preparation | HOECHST AKTIENGESELLSCHAFT (DE) | 1988-06-01 | — | — | EP | disclosed |