Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A1 | P30531 | 3/20 | 0.81 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.49 |
| ▸ | LMNA | P02545 | 4/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.49 |
| ▸ | BLM | P54132 | 2/20 | 0.49 |
| ▸ | PMP22 | Q01453 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL7356644 | 0.96 | SLC6A1 (0.72) | SLC6A1ALDH1A1LMNAKDM4EBLM | |
| SCHEMBL5162505 | 0.90 | SLC6A1 (1.00) | SLC6A1ALDH1A1LMNAKDM4EBLM | |
| Hydrochloric Acid SCHEMBL10964415 | 0.89 | SLC6A1 (0.97) | SLC6A1ALDH1A1LMNAKDM4EBLM | |
| SCHEMBL7358137 | 0.87 | SLC6A1 (0.61) | SLC6A1ALDH1A1LMNAKDM4EBLM | |
| SCHEMBL7399137 | 0.86 | SLC6A1 (0.60) | SLC6A1ALDH1A1LMNAKDM4EBLM | |
| SCHEMBL9526360 | 0.84 | SLC6A1 (0.86) | SLC6A1ALDH1A1LMNAKDM4EBLM | |
| SCHEMBL9526552 | 0.83 | SLC6A1 (0.77) | SLC6A1ALDH1A1LMNAKDM4EBLM | |
| SCHEMBL9525891 | 0.82 | SLC6A1 (0.83) | SLC6A1ALDH1A1LMNAKDM4EBLM | |
| SCHEMBL9525459 | 0.81 | SLC6A1 (0.81) | SLC6A1ALDH1A1LMNAKDM4EBLM | |
| SCHEMBL8820395 | 0.80 | SLC6A1 (0.79) | SLC6A1ALDH1A1LMNAKDM4EBLM |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1997049403-A1 | USE OF NIPECOTIC ACID OR GUVACINE DERIVATIVES FOR THE MANUFACTURE OF A MEDICAMENT FOR THE TREATMENT OF POSTISCHEMIC NEURODEGENERATIVE DISORDERS | UNIVERSITY COLLEGE DUBLIN (US) | 1997-12-31 | — | — | WO | disclosed |
| EP-0231996-B1 | NOVEL AMINO ACID DERIVATIVES | NOVO NORDISK A/S (DK) | 1993-10-06 | — | — | EP | disclosed |
| EP-0231996-A2 | Novel amino acid derivatives | NOVO NORDISK A/S (DK) | 1987-08-12 | — | — | EP | disclosed |