Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | FAAH | O00519 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 2/20 | 0.35 |
| ▸ | ALPL | P05186 | 1/20 | 0.35 |
| ▸ | ALPI | P09923 | 1/20 | 0.35 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 3/20 | 0.33 |
| ▸ | CA1 | P00915 | 3/20 | 0.33 |
| ▸ | CA2 | P00918 | 3/20 | 0.33 |
| ▸ | CA9 | Q16790 | 3/20 | 0.33 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | CA3 | P07451 | 2/20 | 0.33 |
| ▸ | CA4 | P22748 | 2/20 | 0.33 |
| ▸ | CA6 | P23280 | 2/20 | 0.33 |
| ▸ | CA5A | P35218 | 2/20 | 0.33 |
| ▸ | CA7 | P43166 | 2/20 | 0.33 |
| ▸ | CA13 | Q8N1Q1 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL692261 | 0.81 | BRD4 (0.46) | KMT2A | |
| SCHEMBL8349122 | 0.81 | ALPL (0.37) | ALDH1A1HSD17B10TDP1PKMALPL | |
| SCHEMBL6833044 | 0.81 | PTPN1 (0.36) | ALDH1A1HSD17B10TDP1FAAHPKM | |
| SCHEMBL691641 | 0.78 | LMNA (0.39) | ALDH1A1HSD17B10TDP1PKMALPL | |
| SCHEMBL12975343 | 0.78 | BRD4 (0.38) | ALDH1A1HSD17B10TDP1PKMALPL | |
| SCHEMBL4378995 | 0.74 | MAPT (0.39) | ALDH1A1HSD17B10TDP1PKMALPL | |
| SCHEMBL6989194 | 0.74 | FAAH (0.51) | ALDH1A1HSD17B10FAAHMAPTSMN1; SMN2 | |
| SCHEMBL6525933 | 0.74 | L3MBTL1 (0.51) | ALDH1A1HSD17B10TDP1PKMALPL | |
| SCHEMBL692169 | 0.73 | MAPT (0.47) | NPC1MAPTSMN1; SMN2LMNAKMT2A | |
| SCHEMBL6593057 | 0.71 | LMNA (0.46) | ALDH1A1HSD17B10TDP1NPC1CA12 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2422780-A1 | Resistance-repellent retroviral protease inhibitors | Sequoia Pharmaceuticals, Inc. (US) | 2012-02-29 | — | — | EP | disclosed |
| EP-2422781-A1 | Resistance-repellent retroviral protease inhibitors | Sequoia Pharmaceuticals, Inc. (US) | 2012-02-29 | — | — | EP | disclosed |