Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GUSB | P08236 | 1/20 | 0.51 |
| ▸ | RAB9A | P51151 | 7/20 | 0.50 |
| ▸ | NPC1 | O15118 | 6/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | LMNA | P02545 | 3/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.50 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.50 |
| ▸ | CASP3 | P42574 | 1/20 | 0.50 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.50 |
| ▸ | RELA | Q04206 | 1/20 | 0.50 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.50 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.50 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | EGFR | P00533 | 1/20 | 0.48 |
| ▸ | ANO1 | Q5XXA6 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 4/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL6313742 | 0.80 | NPC1 (0.49) | GUSBRAB9ANPC1ALDH1A1LMNA | |
| SCHEMBL18901291 | 0.80 | NOTUM (0.59) | GUSBRAB9ANPC1ALDH1A1LMNA | |
| SCHEMBL27475343 | 0.80 | ALDH1A1 (0.59) | GUSBRAB9ANPC1ALDH1A1LMNA | |
| SCHEMBL6195150 | 0.79 | MAPT (0.43) | GUSBRAB9ANPC1ALDH1A1LMNA | |
| SCHEMBL6451424 | 0.78 | NPC1 (0.64) | GUSBRAB9ANPC1ALDH1A1LMNA | |
| SCHEMBL17790217 | 0.76 | GUSB (0.53) | GUSBRAB9ANPC1ALDH1A1LMNA | |
| SCHEMBL29291257 | 0.76 | ALDH1A1 (0.62) | RAB9ANPC1ALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL13393578 | 0.74 | NPC1 (0.55) | GUSBRAB9ANPC1ALDH1A1LMNA | |
| SCHEMBL17788632 | 0.73 | ANO1 (0.49) | GUSBRAB9ANPC1ALDH1A1LMNA | |
| SCHEMBL23451613 | 0.70 | HPGD (0.55) | GUSBRAB9ANPC1ALDH1A1LMNA |
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-106146487-B | Pyridylmethyl dithiocarbonic acid hetero-aromatic ring alkyl esters compound and its preparation method and application | 北京大学 | 2019-05-10 | — | — | CN | disclosed |