Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | NCF1 | P14598 | 1/20 | 0.37 |
| ▸ | GNAI3 | P08754 | 1/20 | 0.36 |
| ▸ | GNAO1 | P09471 | 1/20 | 0.36 |
| ▸ | GNAI1 | P63096 | 1/20 | 0.36 |
| ▸ | SLC18A3 | Q16572 | 2/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 5/20 | 0.35 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.35 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.35 |
| ▸ | HTR1A | P08908 | 1/20 | 0.33 |
| ▸ | HTR7 | P34969 | 1/20 | 0.33 |
| ▸ | HRH1 | P35367 | 1/20 | 0.33 |
| ▸ | DRD3 | P35462 | 1/20 | 0.33 |
| ▸ | HTR2B | P41595 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL1776518 | 1.00 | ALDH1A1 (0.42) | ALDH1A1NCF1GNAI3GNAO1GNAI1 | |
| SCHEMBL14589323 | 1.00 | ALDH1A1 (0.42) | ALDH1A1NCF1GNAI3GNAO1GNAI1 | |
| SCHEMBL255094 | 1.00 | ALDH1A1 (0.42) | ALDH1A1NCF1GNAI3GNAO1GNAI1 | |
| SCHEMBL14640696 | 1.00 | ALDH1A1 (0.42) | ALDH1A1NCF1GNAI3GNAO1GNAI1 | |
| SCHEMBL443188 | 1.00 | ALDH1A1 (0.42) | ALDH1A1NCF1GNAI3GNAO1GNAI1 | |
| SCHEMBL12440194 | 1.00 | ALDH1A1 (0.42) | ALDH1A1NCF1GNAI3GNAO1GNAI1 | |
| SCHEMBL254415 | 1.00 | ALDH1A1 (0.42) | ALDH1A1NCF1GNAI3GNAO1GNAI1 | |
| SCHEMBL13162976 | 0.97 | ALDH1A1 (0.40) | ALDH1A1NCF1GNAI3GNAO1GNAI1 | |
| SCHEMBL21238903 | 0.97 | ALDH1A1 (0.40) | ALDH1A1NCF1GNAI3GNAO1GNAI1 | |
| SCHEMBL22591830 | 0.97 | ALDH1A1 (0.40) | ALDH1A1NCF1GNAI3GNAO1GNAI1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3305789-A1 | NITROGEN-CONTAINING TRICYCLIC DERIVATIVE HAVING HIV REPLICATION INHIBITORY ACTIVITY | Shionogi & Co., Ltd. (JP) | 2018-04-11 | — | — | EP | disclosed |
| US-7528140-B2 | Substituted pyrrolo[3,2-d]pyrimidines as glycogen synthase kinase (GSK) inhibitors | TEIJIN LIMITED (JP) | 2009-05-05 | — | — | US | disclosed |
| EP-1592684-B1 | MALONAMIDE DERIVATIVES AS GAMMA-SECRETASE INHIBITORS | HOFFMANN LA ROCHE (CH) | 2008-07-30 | — | — | EP | disclosed |
| WO-2004069826-A1 | MALONAMIDE DERIVATIVES AS GAMMA-SECRETASE INHIBITORS | F. HOFFMANN-LA ROCHE AG (CH) | 2004-08-19 | — | — | WO | disclosed |