Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.51 |
| ▸ | RAB9A | P51151 | 2/20 | 0.51 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.50 |
| ▸ | APP | P05067 | 6/20 | 0.45 |
| ▸ | HTR1A | P08908 | 1/20 | 0.45 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.45 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.45 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.45 |
| ▸ | MAOB | P27338 | 2/20 | 0.44 |
| ▸ | IDO1 | P14902 | 2/20 | 0.42 |
| ▸ | AGXT | P21549 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL11413066 | 0.83 | NPC1 (0.52) | NPC1RAB9AABCB1APPHTR1A | |
| SCHEMBL6614268 | 0.83 | NPC1 (0.52) | NPC1RAB9AABCB1APPHTR1A | |
| SCHEMBL27923841 | 0.82 | TDP1 (0.50) | ABCB1HTR1AADRA1DADRA1AADRA1B | |
| SCHEMBL919788 | 0.82 | NPC1 (0.51) | NPC1RAB9AABCB1APPHTR1A | |
| SCHEMBL11413069 | 0.80 | NPC1 (0.49) | NPC1RAB9AABCB1APPHTR1A | |
| SCHEMBL16018989 | 0.78 | ABCB1 (0.68) | NPC1RAB9AABCB1APPHTR1A | |
| SCHEMBL30145233 | 0.78 | ABCB1 (0.59) | NPC1RAB9AABCB1APPHTR1A | |
| SCHEMBL7914167 | 0.78 | ABCB1 (0.59) | NPC1RAB9AABCB1APPHTR1A | |
| SCHEMBL21824613 | 0.76 | NPC1 (0.55) | NPC1RAB9AABCB1APPHTR1A | |
| SCHEMBL29070977 | 0.76 | CYP19A1 (0.46) | NPC1RAB9AABCB1APPHTR1A |
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-116332948-A | Nitrogen-containing tetracyclic compound, preparation method and medicinal application thereof | 翰森生物有限责任公司 | 2023-06-27 | — | — | CN | disclosed |