Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.55 |
| ▸ | RAB9A | P51151 | 6/20 | 0.53 |
| ▸ | NPC1 | O15118 | 5/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.53 |
| ▸ | HPGD | P15428 | 3/20 | 0.53 |
| ▸ | PKM | P14618 | 2/20 | 0.53 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.53 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.53 |
| ▸ | RELA | Q04206 | 2/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.51 |
| ▸ | LMNA | P02545 | 2/20 | 0.51 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.51 |
| ▸ | CASP1 | P29466 | 1/20 | 0.51 |
| ▸ | TP53 | P04637 | 1/20 | 0.51 |
| ▸ | RECQL | P46063 | 2/20 | 0.50 |
| ▸ | THRB | P10828 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 4/20 | 0.47 |
| ▸ | MEN1 | O00255 | 3/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL9360112 | 0.82 | ALDH1A1 (0.62) | ALDH1A1RAB9ANPC1SMN1; SMN2HPGD | |
| SCHEMBL7706764 | 0.82 | THRB (0.56) | ALDH1A1RAB9ANPC1SMN1; SMN2HPGD | |
| SCHEMBL14637286 | 0.81 | ALDH1A1 (0.60) | ALDH1A1RAB9ANPC1SMN1; SMN2HPGD | |
| SCHEMBL14845420 | 0.79 | THRB (0.53) | ALDH1A1RAB9ANPC1SMN1; SMN2HPGD | |
| SCHEMBL6319718 | 0.78 | ALDH1A1 (0.66) | ALDH1A1RAB9ANPC1SMN1; SMN2HPGD | |
| SCHEMBL28862961 | 0.78 | ALDH1A1 (0.50) | ALDH1A1RAB9ANPC1SMN1; SMN2HPGD | |
| SCHEMBL3259608 | 0.77 | ALDH1A1 (0.49) | ALDH1A1RAB9ANPC1SMN1; SMN2HPGD | |
| SCHEMBL2170056 | 0.77 | ALDH1A1 (0.64) | ALDH1A1RAB9ANPC1SMN1; SMN2HPGD | |
| SCHEMBL28727291 | 0.77 | SMN1; SMN2 (0.65) | ALDH1A1RAB9ANPC1SMN1; SMN2HPGD | |
| SCHEMBL836745 | 0.77 | SMN1; SMN2 (0.65) | ALDH1A1RAB9ANPC1SMN1; SMN2HPGD |
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-109942510-B | Thiazole derivative grafted olefin and preparation method and application thereof | 深圳市优宝新材料科技有限公司 | 2020-11-03 | — | — | CN | disclosed |