Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRP | O00591 | 3/20 | 0.82 |
| ▸ | GABRD | O14764 | 3/20 | 0.82 |
| ▸ | GABRA1 | P14867 | 3/20 | 0.82 |
| ▸ | GABRB1 | P18505 | 3/20 | 0.82 |
| ▸ | GABRG2 | P18507 | 3/20 | 0.82 |
| ▸ | GABRB3 | P28472 | 3/20 | 0.82 |
| ▸ | GABRA5 | P31644 | 3/20 | 0.82 |
| ▸ | GABRA3 | P34903 | 3/20 | 0.82 |
| ▸ | GABRA2 | P47869 | 3/20 | 0.82 |
| ▸ | GABRB2 | P47870 | 3/20 | 0.82 |
| ▸ | GABRA4 | P48169 | 3/20 | 0.82 |
| ▸ | GABRE | P78334 | 3/20 | 0.82 |
| ▸ | GABRA6 | Q16445 | 3/20 | 0.82 |
| ▸ | GABRG1 | Q8N1C3 | 3/20 | 0.82 |
| ▸ | GABRG3 | Q99928 | 3/20 | 0.82 |
| ▸ | GABRQ | Q9UN88 | 3/20 | 0.82 |
| ▸ | MAPT | P10636 | 4/20 | 0.68 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.68 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.68 |
| ▸ | LMNA | P02545 | 2/20 | 0.68 |
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 | |
|---|---|---|---|---|
| SCHEMBL28291468 | 0.93 | GABRP (0.79) | GABRPGABRDGABRA1GABRB1GABRG2 | |
| SCHEMBL2361114 | 0.92 | GABRP (0.77) | GABRPGABRDGABRA1GABRB1GABRG2 | |
| SCHEMBL29817605 | 0.91 | GABRP (0.76) | GABRPGABRDGABRA1GABRB1GABRG2 | |
| SCHEMBL30104123 | 0.90 | GABRP (1.00) | GABRPGABRDGABRA1GABRB1GABRG2 | |
| SCHEMBL28290030 | 0.90 | GABRP (1.00) | GABRPGABRDGABRA1GABRB1GABRG2 | |
| SCHEMBL2214523 | 0.89 | GABRP (0.66) | GABRPGABRDGABRA1GABRB1GABRG2 | |
| SCHEMBL29817540 | 0.89 | GABRP (0.84) | GABRPGABRDGABRA1GABRB1GABRG2 | |
| SCHEMBL2043144 | 0.86 | GABRP (0.61) | GABRPGABRDGABRA1GABRB1GABRG2 | |
| SCHEMBL28290033 | 0.85 | GABRP (0.77) | GABRPGABRDGABRA1GABRB1GABRG2 | |
| SCHEMBL30104128 | 0.84 | GABRP (0.75) | GABRPGABRDGABRA1GABRB1GABRG2 |
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-111303148-B | 1-substituted beta-carboline derivatives and application thereof | 南京农业大学 | 2022-08-30 | — | — | CN | disclosed |
| CN-109575020-A | Beta-carboline derivatives and preparation method thereof and application in preparation of anti-tumor drugs | 河北大学 | 2019-04-05 | — | — | CN | disclosed |