Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACACB | O00763 | 4/20 | 0.39 |
| ▸ | NPC1 | O15118 | 3/20 | 0.37 |
| ▸ | RAB9A | P51151 | 3/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.31 |
| ▸ | SCN4A | P35499 | 1/20 | 0.31 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL24476894 | 0.81 | S1PR1 (0.43) | ACACBRAB9AESR1LOXL2SMN1; SMN2 | |
| SCHEMBL18258326 | 0.78 | SMN1; SMN2 (0.52) | NPC1RAB9AGAAMAPK1SMN1; SMN2 | |
| SCHEMBL798536 | 0.78 | ACACB (0.38) | ACACBNPC1RAB9ALOXL2SMN1; SMN2 | |
| SCHEMBL14046224 | 0.78 | ACACB (0.38) | ACACBNPC1RAB9AGAALOXL2 | |
| SCHEMBL2707208 | 0.74 | NPC1 (0.45) | ACACBNPC1RAB9AGAAMAPK1 | |
| SCHEMBL21981998 | 0.74 | ACACB (0.36) | ACACBNPC1RAB9ALOXL2SMN1; SMN2 | |
| SCHEMBL10220089 | 0.72 | RAB9A (0.61) | NPC1RAB9ALOXL2SMN1; SMN2SCN4A | |
| SCHEMBL25706146 | 0.71 | NPC1 (0.41) | ACACBNPC1RAB9AGAAMAPK1 | |
| SCHEMBL23896978 | 0.71 | LOXL2 (0.31) | ACACBLOXL2 | |
| SCHEMBL15935289 | 0.70 | LOXL2 (0.40) | ACACBNPC1RAB9ALOXL2SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021160132-A1 | HETEROCYCLIC COMPOUND, PREPARATION METHOD THEREFOR, AND USE THEREOF | 上海美悦生物科技发展有限公司 | 2021-08-19 | — | — | WO | disclosed |