Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GFER | P55789 | 1/20 | 0.45 |
| ▸ | P2RY1 | P47900 | 6/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | MECP2 | P51608 | 1/20 | 0.43 |
| ▸ | NAMPT | P43490 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | ATR | Q13535 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 3/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | P2RY14 | Q15391 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL30725362 | 0.82 | SMN1; SMN2 (0.46) | GFERP2RY1SMN1; SMN2MAPTMAPK1 | |
| SCHEMBL29128651 | 0.82 | SMN1; SMN2 (0.46) | GFERP2RY1SMN1; SMN2MAPTMAPK1 | |
| SCHEMBL50243 | 0.80 | MEN1 (0.55) | GFERSMN1; SMN2MAPTNAMPTALDH1A1 | |
| SCHEMBL1725253 | 0.80 | ALDH1A1 (0.49) | GFERP2RY1SMN1; SMN2MAPTNAMPT | |
| SCHEMBL29128670 | 0.76 | MAPK1 (0.47) | MAPK1NAMPT | |
| SCHEMBL8495853 | 0.76 | CETP (0.47) | GFERP2RY1SMN1; SMN2ALDH1A1ATR | |
| SCHEMBL12182365 | 0.76 | BRD4 (0.50) | SMN1; SMN2MAPTMAPK1NAMPTALDH1A1 | |
| SCHEMBL27483343 | 0.74 | FNTA (0.49) | SMN1; SMN2MAPTALDH1A1POLBMEN1 | |
| SCHEMBL1723318 | 0.73 | METAP1 (0.54) | P2RY1NAMPTALDH1A1ATRP2RY14 | |
| SCHEMBL30283184 | 0.73 | METAP1 (0.54) | P2RY1NAMPTALDH1A1ATRP2RY14 |
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 |
|---|---|---|---|---|---|---|---|
| CN-117263873-A | 1, 4-benzodiazepine compounds and application thereof in preparation of antitumor drugs | 复旦大学 | 2023-12-22 | — | — | CN | disclosed |