Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | ACHE | P22303 | 2/20 | 0.40 |
| ▸ | HTR4 | Q13639 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 3/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | HTR6 | P50406 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | DRD2 | P14416 | 1/20 | 0.35 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.35 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.35 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.35 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL29803041 | 1.00 | ALDH1A1 (0.40) | ALDH1A1SMN1; SMN2HTTACHEHTR4 | |
| SCHEMBL29803399 | 0.96 | ALDH1A1 (0.40) | ALDH1A1SMN1; SMN2HTTACHEHTR4 | |
| SCHEMBL28795243 | 0.96 | ALDH1A1 (0.40) | ALDH1A1SMN1; SMN2HTTACHEHTR4 | |
| SCHEMBL28795367 | 0.92 | ALDH1A1 (0.45) | ALDH1A1SMN1; SMN2HTTACHEHTR4 | |
| SCHEMBL29803100 | 0.92 | ALDH1A1 (0.45) | ALDH1A1SMN1; SMN2HTTACHEHTR4 | |
| SCHEMBL29803421 | 0.91 | ALDH1A1 (0.39) | ALDH1A1SMN1; SMN2HTTGAAPOLB | |
| SCHEMBL28795155 | 0.91 | ALDH1A1 (0.39) | ALDH1A1SMN1; SMN2HTTGAAPOLB | |
| SCHEMBL29803047 | 0.90 | ACHE (0.41) | ALDH1A1SMN1; SMN2HTTACHEHTR4 | |
| SCHEMBL28795370 | 0.90 | ACHE (0.41) | ALDH1A1SMN1; SMN2HTTACHEHTR4 | |
| SCHEMBL28795421 | 0.89 | ALDH1A1 (0.41) | ALDH1A1SMN1; SMN2HTTGAAKMT2A |
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-114805303-A | Molecule with double functions of degrading EGFR (epidermal growth factor receptor), composition and pharmaceutical application thereof | 海思科医药集团股份有限公司 | 2022-07-29 | — | — | CN | disclosed |