Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC7A5 | Q01650 | 2/20 | 0.44 |
| ▸ | GABRP | O00591 | 2/20 | 0.40 |
| ▸ | GABRD | O14764 | 2/20 | 0.40 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.40 |
| ▸ | GABRB1 | P18505 | 2/20 | 0.40 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.40 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.40 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.40 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.40 |
| ▸ | GABRA2 | P47869 | 2/20 | 0.40 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.40 |
| ▸ | GABRA4 | P48169 | 2/20 | 0.40 |
| ▸ | GABRE | P78334 | 2/20 | 0.40 |
| ▸ | GABRA6 | Q16445 | 2/20 | 0.40 |
| ▸ | GABRG1 | Q8N1C3 | 2/20 | 0.40 |
| ▸ | GABRG3 | Q99928 | 2/20 | 0.40 |
| ▸ | GABRQ | Q9UN88 | 2/20 | 0.40 |
| ▸ | LTA4H | P09960 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8641185 | 0.86 | SLC7A5 (0.43) | SLC7A5GABRPGABRDGABRA1GABRB1 | |
| SCHEMBL15673290 | 0.84 | SLC7A5 (0.41) | SLC7A5GABRPGABRDGABRA1GABRB1 | |
| SCHEMBL4716019 | 0.83 | GABRP (0.60) | SLC7A5GABRPGABRDGABRA1GABRB1 | |
| SCHEMBL28559454 | 0.82 | KDM4E (0.45) | SLC7A5GABRPGABRDGABRA1GABRB1 | |
| SCHEMBL15649084 | 0.82 | KMT2A (0.52) | ALDH1A1TDP1GRIK1GRIK2ALOX15 | |
| SCHEMBL13279300 | 0.82 | KMT2A (0.52) | ALDH1A1TDP1GRIK1GRIK2ALOX15 | |
| SCHEMBL15650629 | 0.82 | KMT2A (0.52) | ALDH1A1TDP1GRIK1GRIK2ALOX15 | |
| SCHEMBL23420704 | 0.81 | SLC7A5 (0.46) | SLC7A5GABRPGABRDGABRA1GABRB1 | |
| SCHEMBL1236551 | 0.81 | ALOX15 (0.56) | SLC7A5GABRPGABRDGABRA1GABRB1 | |
| SCHEMBL5320168 | 0.81 | ALOX15 (0.56) | SLC7A5GABRPGABRDGABRA1GABRB1 |
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-116546988-A | Prodrugs of 5α -hydroxy-6β - [2- (1H-imidazol-4-yl) ethylamino ] cholestan-3β -ol and pharmaceutical compositions for cancer treatment containing the same | 登德罗杰尼克斯公司 | 2023-08-04 | — | — | CN | disclosed |