Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RARB | P10826 | 2/20 | 0.43 |
| ▸ | RARG | P13631 | 2/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | RECQL | P46063 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | IAPP | P10997 | 1/20 | 0.34 |
| ▸ | RARA | P10276 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL30133991 | 1.00 | RARB (0.43) | RARBRARGMAPK1NPC1RAB9A | |
| SCHEMBL30625585 | 0.86 | RARB (0.45) | RARBRARGMAPK1NPC1RAB9A | |
| SCHEMBL30133889 | 0.83 | RARB (0.39) | RARBRARGRAB9AKDM4EL3MBTL1 | |
| SCHEMBL30540591 | 0.83 | MAP3K14 (0.39) | RARBRARGRARA | |
| SCHEMBL30134106 | 0.83 | RARB (0.36) | RARBRARGKDM4ERARA | |
| SCHEMBL24796916 | 0.82 | MAP4K1 (0.40) | MAPK1NPC1RAB9ASMN1; SMN2PTGER4 | |
| SCHEMBL30133894 | 0.81 | CLK1 (0.33) | RARBRARGRARA | |
| SCHEMBL25349041 | 0.73 | NQO2 (0.38) | RARBRARG | |
| SCHEMBL25359958 | 0.73 | MAPT (0.36) | RARBRARGMAPK1SMN1; SMN2KDM4E | |
| SCHEMBL25361564 | 0.72 | RARB (0.35) | RARBRARGMAPK1SMN1; SMN2KDM4E |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118696043-A | Heterocyclic compounds, compositions thereof and methods of treatment therewith | 百济神州有限公司 | 2024-09-24 | — | — | CN | disclosed |
| CN-117836296-A | Pyrazolopyridone compounds | 百济神州有限公司 | 2024-04-05 | — | — | CN | disclosed |