Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 3/20 | 0.46 |
| ▸ | LCK | P06239 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | GABRP | O00591 | 2/20 | 0.42 |
| ▸ | GABRD | O14764 | 2/20 | 0.42 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.42 |
| ▸ | GABRB1 | P18505 | 2/20 | 0.42 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.42 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.42 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.42 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.42 |
| ▸ | GABRA2 | P47869 | 2/20 | 0.42 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.42 |
| ▸ | GABRA4 | P48169 | 2/20 | 0.42 |
| ▸ | GABRE | P78334 | 2/20 | 0.42 |
| ▸ | GABRA6 | Q16445 | 2/20 | 0.42 |
| ▸ | GABRG1 | Q8N1C3 | 2/20 | 0.42 |
| ▸ | GABRG3 | Q99928 | 2/20 | 0.42 |
| ▸ | GABRQ | Q9UN88 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL17130053 | 1.00 | MAPK1 (0.46) | MAPK1LCKMAPTGABRPGABRD | |
| SCHEMBL21652771 | 0.86 | MAPK1 (0.46) | MAPK1LCKMAPTGABRPGABRD | |
| SCHEMBL1459953 | 0.81 | MAPK1 (0.47) | MAPK1LCKMAPTGABRPGABRD | |
| SCHEMBL23611991 | 0.81 | LCK (0.53) | MAPK1LCKMAPTGABRPGABRD | |
| SCHEMBL9400422 | 0.81 | MAPK1 (0.47) | MAPK1LCKMAPTGABRPGABRD | |
| SCHEMBL16318862 | 0.79 | MAPK1 (0.46) | MAPK1LCKMAPTGABRPGABRD | |
| SCHEMBL18340557 | 0.79 | MAPK1 (0.46) | MAPK1LCKMAPTGABRPGABRD | |
| SCHEMBL29260500 | 0.79 | MAPK1 (0.46) | MAPK1LCKMAPTGABRPGABRD | |
| SCHEMBL23481999 | 0.79 | MAPK1 (0.50) | MAPK1LCKMAPTGABRPGABRD | |
| SCHEMBL31435378 | 0.79 | NOTUM (0.55) | MAPK1LCKMAPTGABRPGABRD |
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-115919859-B | Pharmaceutical composition of heteroaryl derivative and application of pharmaceutical composition in medicine | 四川海思科制药有限公司 | 2024-01-05 | — | — | CN | disclosed |
| CN-115919859-A | Pharmaceutical composition of heteroaryl derivative and application thereof in medicine | 四川海思科制药有限公司 | 2023-04-07 | — | — | CN | disclosed |