Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.55 |
| ▸ | CCR6 | P51684 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 11/20 | 0.52 |
| ▸ | MAPT | P10636 | 6/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.52 |
| ▸ | LMNA | P02545 | 4/20 | 0.52 |
| ▸ | MEN1 | O00255 | 2/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.52 |
| ▸ | DYRK2 | Q92630 | 4/20 | 0.48 |
| ▸ | DYRK1A | Q13627 | 3/20 | 0.48 |
| ▸ | DYRK1B | Q9Y463 | 3/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 5/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.45 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL11501993 | 1.00 | HSP90AA1 (0.55) | HSP90AA1CCR6ALDH1A1MAPTTDP1 | |
| SCHEMBL2182422 | 0.81 | HSP90AA1 (0.62) | HSP90AA1CCR6ALDH1A1MAPTLMNA | |
| SCHEMBL2182419 | 0.81 | HSP90AA1 (0.62) | HSP90AA1CCR6ALDH1A1MAPTLMNA | |
| SCHEMBL11501743 | 0.75 | ALDH1A1 (0.44) | ALDH1A1MAPTTDP1LMNAMEN1 | |
| SCHEMBL11501744 | 0.75 | ALDH1A1 (0.44) | ALDH1A1MAPTTDP1LMNAMEN1 | |
| SCHEMBL11501952 | 0.75 | ALDH1A1 (0.65) | ALDH1A1MAPTTDP1LMNAMEN1 | |
| SCHEMBL11501954 | 0.75 | ALDH1A1 (0.65) | ALDH1A1MAPTTDP1LMNAMEN1 | |
| Hydrochloric Acid SCHEMBL28783968 | 0.73 | HSP90AA1 (0.74) | HSP90AA1CCR6ALDH1A1MAPTLMNA | |
| Hydrochloric Acid SCHEMBL27782019 | 0.73 | HSP90AA1 (0.78) | HSP90AA1CCR6ALDH1A1MAPTLMNA | |
| Hydrochloric Acid SCHEMBL27803553 | 0.73 | HSP90AA1 (0.73) | HSP90AA1CCR6ALDH1A1MAPTLMNA |
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-4177271-A | ANTIDEPRESSANTS, HYPNOTICS | UNICLER (FR) | 1979-12-04 | — | — | US | disclosed |