Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GLS | O94925 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 3/20 | 0.42 |
| ▸ | MAPT | P10636 | 7/20 | 0.41 |
| ▸ | KMO | O15229 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.40 |
| ▸ | NOS1 | P29475 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | NPBWR1 | P48145 | 1/20 | 0.38 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.38 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.37 |
| ▸ | CDC7 | O00311 | 1/20 | 0.37 |
| ▸ | MAOB | P27338 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL25273981 | 0.89 | GLS (0.52) | GLSMAPTLMNANOS1CYP3A4 | |
| SCHEMBL31510404 | 0.88 | GLS (0.45) | GLSNPC1MAPTKMOLMNA | |
| SCHEMBL2144733 | 0.88 | GLS (0.45) | GLSNPC1MAPTKMOLMNA | |
| SCHEMBL15910897 | 0.82 | GLS (0.45) | GLSNPC1MAPTLMNANOS1 | |
| SCHEMBL30168559 | 0.82 | GLS (0.45) | GLSNPC1MAPTLMNANOS1 | |
| SCHEMBL9332638 | 0.80 | MAPT (0.51) | NPC1MAPTKMOLMNAMEN1 | |
| SCHEMBL8951215 | 0.79 | GLS (0.49) | GLSNPC1MAPTLMNANOS1 | |
| SCHEMBL27800006 | 0.77 | NPC1 (0.37) | GLSNPC1MAPTKMOLMNA | |
| SCHEMBL427515 | 0.77 | GLS (0.55) | GLSNPC1MAPTLMNANOS1 | |
| SCHEMBL5352816 | 0.77 | GLS (0.55) | GLSMAPTLMNANOS1CYP3A4 |
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-113896744-B | Selective EGFR inhibitor | 成都先导药物开发股份有限公司 | 2024-04-16 | — | — | CN | disclosed |