Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 15/20 | 0.65 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.65 |
| ▸ | HTT | P42858 | 1/20 | 0.65 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.47 |
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.47 |
| ▸ | MITF | O75030 | 1/20 | 0.47 |
| ▸ | THRB | P10828 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 5/20 | 0.45 |
| ▸ | HPGD | P15428 | 3/20 | 0.45 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | EGFR | P00533 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL31451568 | 0.84 | ALDH1A1 (0.63) | ALDH1A1SMN1; SMN2HTTKDM4ENPC1 | |
| SCHEMBL4967512 | 0.84 | ALDH1A1 (0.63) | ALDH1A1SMN1; SMN2HTTKDM4ENPC1 | |
| SCHEMBL3952909 | 0.79 | ALDH1A1 (0.68) | ALDH1A1SMN1; SMN2HTTNPC1KMT2A | |
| SCHEMBL11056444 | 0.79 | KMT2A (0.46) | ALDH1A1SMN1; SMN2HTTKDM4EMAPK1 | |
| SCHEMBL4228749 | 0.79 | SMN1; SMN2 (1.00) | ALDH1A1SMN1; SMN2HTTMAPK1THRB | |
| SCHEMBL4001716 | 0.79 | ALDH1A1 (0.75) | ALDH1A1SMN1; SMN2HTTKMT2AMEN1 | |
| SCHEMBL29643255 | 0.79 | SMN1; SMN2 (1.00) | ALDH1A1SMN1; SMN2HTTMAPK1THRB | |
| SCHEMBL11232605 | 0.76 | ALDH1A1 (0.66) | ALDH1A1SMN1; SMN2HTTKDM4ENPC1 | |
| SCHEMBL11005489 | 0.76 | ALDH1A1 (0.58) | ALDH1A1SMN1; SMN2HTTKDM4ENPC1 | |
| SCHEMBL4002461 | 0.75 | HDAC3 (0.62) | ALDH1A1SMN1; SMN2HTTKDM4ENPC1 |
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-114072000-A | Molecules having certain pesticidal effects and intermediates, compositions and methods related thereto | 科迪华农业科技有限责任公司 | 2022-02-18 | — | — | CN | disclosed |