Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP14 | Q460N5 | 2/20 | 0.38 |
| ▸ | GABRP | O00591 | 2/20 | 0.37 |
| ▸ | GABRD | O14764 | 2/20 | 0.37 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.37 |
| ▸ | GABRB1 | P18505 | 2/20 | 0.37 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.37 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.37 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.37 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.37 |
| ▸ | GABRA2 | P47869 | 2/20 | 0.37 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.37 |
| ▸ | GABRA4 | P48169 | 2/20 | 0.37 |
| ▸ | GABRE | P78334 | 2/20 | 0.37 |
| ▸ | GABRA6 | Q16445 | 2/20 | 0.37 |
| ▸ | GABRG1 | Q8N1C3 | 2/20 | 0.37 |
| ▸ | GABRG3 | Q99928 | 2/20 | 0.37 |
| ▸ | GABRQ | Q9UN88 | 2/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.37 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL29045924 | 1.00 | PARP14 (0.38) | PARP14GABRPGABRDGABRA1GABRB1 | |
| SCHEMBL29986915 | 0.84 | L3MBTL1 (0.41) | PARP14L3MBTL1ROCK2MAPK1KDM4E | |
| SCHEMBL29045950 | 0.84 | L3MBTL1 (0.41) | PARP14L3MBTL1ROCK2MAPK1KDM4E | |
| SCHEMBL29045947 | 0.84 | L3MBTL1 (0.41) | PARP14L3MBTL1ROCK2MAPK1KDM4E | |
| SCHEMBL29045951 | 0.83 | PARP14 (0.54) | PARP14GABRPGABRDGABRA1GABRB1 | |
| SCHEMBL29045946 | 0.83 | PARP14 (0.54) | PARP14GABRPGABRDGABRA1GABRB1 | |
| SCHEMBL29986906 | 0.79 | BCHE (0.49) | PARP14L3MBTL1ROCK2KDM4EALDH1A1 | |
| SCHEMBL29045901 | 0.79 | BCHE (0.49) | PARP14L3MBTL1ROCK2KDM4EALDH1A1 | |
| SCHEMBL29045899 | 0.79 | BCHE (0.49) | PARP14L3MBTL1ROCK2KDM4EALDH1A1 | |
| SCHEMBL29045871 | 0.76 | DYRK1A (0.41) | PARP14L3MBTL1ROCK2KDM4EALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115304597-B | Beta-carboline compounds and application thereof in preparation of medicines for treating or preventing tumor diseases | 中国科学院深圳先进技术研究院 | 2023-10-20 | — | — | CN | disclosed |
| CN-115304597-A | Beta-carboline compounds and application thereof in preparing medicines for treating or preventing tumor diseases | 中国科学院深圳先进技术研究院 | 2022-11-08 | — | — | CN | disclosed |