Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.49 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.49 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.48 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.43 |
| ▸ | PARP1 | P09874 | 1/20 | 0.43 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.43 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL27802495 | 0.90 | CHRNB2 (0.51) | ALDH1A1MAPTHTTCHRNB2CHRNA4 | |
| SCHEMBL27779058 | 0.89 | ALDH1A1 (0.53) | ALDH1A1MAPTHTTCHRNB2CHRNA4 | |
| SCHEMBL27778860 | 0.89 | ALDH1A1 (0.53) | ALDH1A1MAPTHTTCHRNB2CHRNA4 | |
| SCHEMBL27778861 | 0.89 | ALDH1A1 (0.53) | ALDH1A1MAPTHTTCHRNB2CHRNA4 | |
| SCHEMBL13535271 | 0.88 | KMT2A (0.49) | ALDH1A1MAPTHTTCHRNB2CHRNA4 | |
| SCHEMBL7808456 | 0.84 | SIGMAR1 (0.49) | ALDH1A1SIRT1KDM4EKMT2ASIGMAR1 | |
| SCHEMBL5191569 | 0.83 | ALDH1A1 (0.47) | ALDH1A1MAPTHTTCHRNB2CHRNA4 | |
| SCHEMBL29976288 | 0.82 | ALDH1A1 (0.44) | ALDH1A1MAPTHTTCHRNB2CHRNA4 | |
| SCHEMBL13535512 | 0.79 | CHRNB2 (0.56) | ALDH1A1MAPTHTTCHRNB2CHRNA4 | |
| SCHEMBL30471711 | 0.77 | MLNR (0.51) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2015097667-A2 | A COMPOSITION, PROCESS OF PREPARATION OF SAID COMPOSITION, KIT AND A METHOD OF TREATING CANCER | CELLWORKS GROUP, INC., (US) | 2015-07-02 | — | — | WO | disclosed |
| EP-0968206-B8 | N-HETEROCYCLIC DERIVATIVES AS NOS INHIBITORS | BERLEX INC (US) | 2007-01-24 | — | — | EP | disclosed |
| EP-0968206-A1 | N-HETEROCYCLIC DERIVATIVES AS NOS INHIBITORS | BERLEX LABORATORIES, INC. (US) | 2000-01-05 | — | — | EP | disclosed |
| WO-1998037079-A1 | N-HETEROCYCLIC DERIVATIVES AS NOS INHIBITORS | BERLEX LABORATORIES, INC. (US) | 1998-08-27 | — | — | WO | disclosed |