Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 4/20 | 0.45 |
| ▸ | RAB9A | P51151 | 4/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | MAPT | P10636 | 3/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | PKM | P14618 | 1/20 | 0.45 |
| ▸ | SUV39H2 | Q9H5I1 | 6/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.42 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.42 |
| ▸ | RELA | Q04206 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 4/20 | 0.41 |
| ▸ | TLR9 | Q9NR96 | 2/20 | 0.39 |
| ▸ | TLR7 | Q9NYK1 | 2/20 | 0.39 |
| ▸ | ESR1 | P03372 | 1/20 | 0.38 |
| ▸ | CASP1 | P29466 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | IDO1 | P14902 | 1/20 | 0.38 |
| ▸ | TDO2 | P48775 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL15068501 | 1.00 | NPC1 (0.45) | NPC1RAB9AALDH1A1MAPTLMNA | |
| SCHEMBL15068779 | 0.89 | NPC1 (0.44) | NPC1RAB9AALDH1A1MAPTLMNA | |
| SCHEMBL15069070 | 0.89 | NPC1 (0.47) | NPC1RAB9AALDH1A1MAPTLMNA | |
| SCHEMBL15069225 | 0.88 | SUV39H2 (0.48) | NPC1RAB9AALDH1A1MAPTLMNA | |
| SCHEMBL30708168 | 0.88 | SUV39H2 (0.48) | NPC1RAB9AALDH1A1MAPTLMNA | |
| SCHEMBL27261158 | 0.87 | ALDH1A1 (0.43) | NPC1RAB9AALDH1A1MAPTLMNA | |
| SCHEMBL27261032 | 0.87 | NPC1 (0.48) | NPC1RAB9AALDH1A1MAPTLMNA | |
| SCHEMBL15068751 | 0.87 | NPC1 (0.41) | NPC1RAB9AALDH1A1MAPTLMNA | |
| SCHEMBL15068921 | 0.86 | NPC1 (0.41) | NPC1RAB9AALDH1A1MAPTLMNA | |
| SCHEMBL16669726 | 0.85 | NPC1 (0.45) | NPC1RAB9AALDH1A1MAPTLMNA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2024006287-A2 | ANTIVIRAL COMPOUNDS USEFUL AGAINST SARS-COV-2 | UNIVERSITY OF KANSAS (US) | 2024-01-04 | — | — | WO | claimed |
| WO-2024006287-A2 | ANTIVIRAL COMPOUNDS USEFUL AGAINST SARS-COV-2 | UNIVERSITY OF KANSAS (US) | 2024-01-04 | — | — | WO | disclosed |