Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.59 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.59 |
| ▸ | TSHR | P16473 | 1/20 | 0.57 |
| ▸ | HTR7 | P34969 | 2/20 | 0.56 |
| ▸ | HTR1A | P08908 | 1/20 | 0.56 |
| ▸ | DRD2 | P14416 | 1/20 | 0.56 |
| ▸ | HTR2A | P28223 | 1/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.55 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.53 |
| ▸ | ATM | Q13315 | 1/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.53 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 1/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.53 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL7843770 | 0.91 | ALDH1A1 (0.53) | ALDH1A1KDM4ETSHRHTR7HTR1A | |
| SCHEMBL7606382 | 0.86 | SLC6A1 (0.57) | — | |
| SCHEMBL8195865 | 0.86 | ALDH1A1 (0.59) | ALDH1A1KDM4ETSHRHTR7HTR1A | |
| SCHEMBL8195860 | 0.86 | ALDH1A1 (0.59) | ALDH1A1KDM4ETSHRHTR7HTR1A | |
| Hydrochloric Acid SCHEMBL8715054 | 0.85 | SLC6A1 (0.56) | — | |
| SCHEMBL8194975 | 0.82 | ALDH1A1 (0.54) | ALDH1A1KDM4EHTR7HTR1ADRD2 | |
| SCHEMBL8171926 | 0.81 | KDM4E (0.56) | ALDH1A1KDM4ETSHRHTR7HTR1A | |
| SCHEMBL8171924 | 0.81 | KDM4E (0.56) | ALDH1A1KDM4ETSHRHTR7HTR1A | |
| SCHEMBL8196471 | 0.80 | SLC6A1 (0.63) | ALDH1A1KDM4EHTR7HTR1ADRD2 | |
| SCHEMBL8196728 | 0.80 | SLC6A1 (0.63) | ALDH1A1KDM4EHTR7HTR1ADRD2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0820450-B1 | N-substituted azaheterocyclic carboxylic acids and alkylesters thereof | NOVO NORDISK AS (DK) | 2001-09-12 | — | — | EP | disclosed |
| EP-0820450-A1 | NOVEL HETEROCYCLIC COMPOUNDS | NOVO NORDISK A/S (DK) | 1998-01-28 | — | — | EP | disclosed |
| WO-1996031497-A1 | NOVEL HETEROCYCLIC COMPOUNDS | NOVO NORDISK A/S (DK) | 1996-10-10 | — | — | WO | disclosed |