Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 6/20 | 0.70 |
| ▸ | MEN1 | O00255 | 5/20 | 0.70 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.70 |
| ▸ | RAB9A | P51151 | 4/20 | 0.70 |
| ▸ | TP53 | P04637 | 4/20 | 0.70 |
| ▸ | LMNA | P02545 | 1/20 | 0.58 |
| ▸ | GAA | P10253 | 1/20 | 0.58 |
| ▸ | HTT | P42858 | 1/20 | 0.58 |
| ▸ | TOP1 | P11387 | 2/20 | 0.54 |
| ▸ | TERT | O14746 | 1/20 | 0.54 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.54 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.53 |
| ▸ | POLB | P06746 | 1/20 | 0.52 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.52 |
| ▸ | TOP2A | P11388 | 1/20 | 0.51 |
| ▸ | TOP2B | Q02880 | 1/20 | 0.51 |
| ▸ | KDM1A | O60341 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL651227 | 1.00 | NPC1 (0.70) | NPC1MEN1KMT2ARAB9ATP53 | |
| SCHEMBL6029925 | 0.91 | NPC1 (0.82) | NPC1MEN1KMT2ARAB9ATP53 | |
| SCHEMBL3661213 | 0.85 | NPC1 (0.74) | NPC1MEN1KMT2ARAB9ATP53 | |
| SCHEMBL1470784 | 0.85 | NPC1 (0.73) | NPC1MEN1KMT2ARAB9ATP53 | |
| SCHEMBL4946074 | 0.85 | NPC1 (0.73) | NPC1MEN1KMT2ARAB9ATP53 | |
| SCHEMBL308111 | 0.84 | NPC1 (0.72) | NPC1MEN1KMT2ARAB9ATP53 | |
| SCHEMBL11523681 | 0.82 | NPC1 (1.00) | NPC1MEN1KMT2ARAB9ATP53 | |
| SCHEMBL16404286 | 0.82 | NPC1 (0.70) | NPC1MEN1KMT2ARAB9ATP53 | |
| SCHEMBL16335223 | 0.82 | MEN1 (0.79) | NPC1MEN1KMT2ARAB9ATP53 | |
| SCHEMBL12431980 | 0.81 | NPC1 (0.68) | NPC1MEN1KMT2ARAB9ATP53 |
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-116751105-A | Preparation method of 4-bromocyclopropylbenzene | 爱斯特（成都）生物制药股份有限公司 | 2023-09-15 | — | — | CN | disclosed |