Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 6/20 | 0.50 |
| ▸ | RAB9A | P51151 | 6/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.50 |
| ▸ | MAPT | P10636 | 6/20 | 0.46 |
| ▸ | POLB | P06746 | 2/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.44 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.44 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 4/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 5/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.40 |
| ▸ | TP53 | P04637 | 2/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL27851482 | 0.86 | MAPT (0.48) | NPC1RAB9AL3MBTL1MAPTPOLB | |
| SCHEMBL27868449 | 0.85 | ALDH1A1 (0.53) | NPC1RAB9AL3MBTL1MAPTPOLB | |
| SCHEMBL28826451 | 0.82 | SUCNR1 (0.47) | NPC1RAB9AMAPTPOLBHPGD | |
| SCHEMBL27851505 | 0.80 | MAPT (0.45) | NPC1RAB9AL3MBTL1MAPTPOLB | |
| SCHEMBL29082692 | 0.79 | NOTUM (0.46) | NPC1RAB9AL3MBTL1MAPTPOLB | |
| SCHEMBL27921878 | 0.77 | PTGS2 (0.48) | NPC1RAB9APOLBHTTKMT2A | |
| SCHEMBL30889117 | 0.73 | NPC1 (0.63) | NPC1RAB9AL3MBTL1MAPTPOLB | |
| SCHEMBL30889116 | 0.73 | NPC1 (0.63) | NPC1RAB9AL3MBTL1MAPTPOLB | |
| SCHEMBL5117429 | 0.72 | ALDH1A1 (0.68) | NPC1RAB9AL3MBTL1MAPTPOLB | |
| SCHEMBL28494999 | 0.72 | NOTUM (0.68) | NPC1RAB9AL3MBTL1MAPTPOLB |
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-116768877-A | ISR inhibitor and preparation method and application thereof | 中国药科大学 | 2023-09-19 | — | — | CN | disclosed |