Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 5/20 | 0.51 |
| ▸ | RAB9A | P51151 | 5/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.51 |
| ▸ | HTT | P42858 | 3/20 | 0.51 |
| ▸ | MEN1 | O00255 | 7/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 7/20 | 0.51 |
| ▸ | MAPT | P10636 | 5/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.51 |
| ▸ | AVPR2 | P30518 | 1/20 | 0.50 |
| ▸ | GPR27 | Q9NS67 | 1/20 | 0.50 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.49 |
| ▸ | TMPRSS4 | Q9NRS4 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | CASP1 | P29466 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.47 |
| ▸ | PPARG | P37231 | 1/20 | 0.47 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL4215245 | 0.89 | JAK2 (0.49) | NPC1RAB9AHTTMEN1KMT2A | |
| SCHEMBL30961552 | 0.83 | GRIK1 (0.50) | NPC1RAB9AALDH1A1HTTMEN1 | |
| SCHEMBL28582168 | 0.83 | KMT2A (0.43) | NPC1RAB9AALDH1A1HTTMEN1 | |
| SCHEMBL28576262 | 0.83 | MEN1 (0.61) | NPC1RAB9AALDH1A1MEN1KMT2A | |
| SCHEMBL662013 | 0.83 | GRIK1 (0.50) | NPC1RAB9AALDH1A1HTTMEN1 | |
| SCHEMBL24238348 | 0.83 | GRIK1 (0.50) | NPC1RAB9AMEN1KMT2AMAPT | |
| SCHEMBL30961556 | 0.83 | GRIK1 (0.50) | NPC1RAB9AMEN1KMT2AMAPT | |
| SCHEMBL28572762 | 0.83 | HPGD (0.44) | NPC1RAB9AALDH1A1HTTMEN1 | |
| SCHEMBL14024175 | 0.83 | NPC1 (0.47) | NPC1RAB9AHTTMEN1KMT2A | |
| SCHEMBL7829720 | 0.82 | SMO (0.50) | NPC1RAB9AALDH1A1HTTMEN1 |
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-108084110-B | 3-aminobenzo [ d ] isothiazole, derivative and synthetic method thereof | 湘潭大学 | 2021-05-07 | — | — | CN | disclosed |