Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 3/20 | 0.50 |
| ▸ | GABRG2 | P18507 | 3/20 | 0.50 |
| ▸ | GABRB3 | P28472 | 3/20 | 0.50 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.49 |
| ▸ | RAB9A | P51151 | 3/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.49 |
| ▸ | XBP1 | P17861 | 1/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.49 |
| ▸ | MAPK10 | P53779 | 2/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.43 |
| ▸ | POLB | P06746 | 2/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | PARP1 | P09874 | 1/20 | 0.43 |
| ▸ | RECQL | P46063 | 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 | |
|---|---|---|---|---|
| SCHEMBL2566020 | 0.85 | ALDH1A1 (0.51) | ALDH1A1RAB9AMAPTMAPK1LMNA | |
| SCHEMBL2566022 | 0.85 | ALDH1A1 (0.51) | ALDH1A1RAB9AMAPTMAPK1LMNA | |
| SCHEMBL3289274 | 0.85 | ALDH1A1 (0.51) | ALDH1A1RAB9AMAPTMAPK1LMNA | |
| SCHEMBL28420371 | 0.85 | ALDH1A1 (0.51) | ALDH1A1RAB9AMAPTMAPK1LMNA | |
| SCHEMBL8307774 | 0.84 | GABRA1 (0.49) | GABRA1GABRG2GABRB3GABRB2ALDH1A1 | |
| SCHEMBL28892760 | 0.83 | ALDH1A1 (0.64) | ALDH1A1RAB9AMAPTMAPK1LMNA | |
| SCHEMBL1876606 | 0.81 | ALDH1A1 (0.41) | ALDH1A1RAB9AMAPTMAPK1LMNA | |
| SCHEMBL8234794 | 0.81 | ALDH1A1 (0.41) | ALDH1A1RAB9AMAPTMAPK1LMNA | |
| SCHEMBL1876605 | 0.81 | ALDH1A1 (0.41) | ALDH1A1RAB9AMAPTMAPK1LMNA | |
| SCHEMBL548316 | 0.81 | ALDH1A1 (0.47) | GABRA1GABRG2GABRB3GABRB2ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-4051266-A1 | 4-AMINOBUT-2-ENAMIDE DERIVATIVES AND SALTS THEREOF | Taiho Pharmaceutical Co., Ltd. (JP) | 2022-09-07 | — | — | EP | disclosed |