Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 7/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.45 |
| ▸ | HPGD | P15428 | 5/20 | 0.45 |
| ▸ | NPC1 | O15118 | 5/20 | 0.45 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.45 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.45 |
| ▸ | RELA | Q04206 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | HPGDS | O60760 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | RORC | P51449 | 1/20 | 0.39 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28857201 | 0.81 | HPGDS (0.53) | RAB9AALDH1A1HPGDNPC1NFKB1 | |
| SCHEMBL11341286 | 0.79 | ALDH1A1 (0.45) | RAB9AALDH1A1HPGDNPC1NFKB1 | |
| SCHEMBL11341283 | 0.79 | ALDH1A1 (0.45) | RAB9AALDH1A1HPGDNPC1NFKB1 | |
| SCHEMBL18734638 | 0.78 | RAB9A (0.50) | RAB9AALDH1A1HPGDNPC1NFKB1 | |
| SCHEMBL8969122 | 0.75 | TSHR (0.51) | RAB9AALDH1A1HPGDNPC1NFKB1 | |
| SCHEMBL11857829 | 0.74 | ALDH1A1 (0.62) | RAB9AALDH1A1NPC1LMNAMAPT | |
| SCHEMBL9661207 | 0.74 | ALDH1A1 (0.50) | RAB9AALDH1A1HPGDNPC1NFKB1 | |
| SCHEMBL28319570 | 0.73 | ALDH1A1 (0.44) | RAB9AALDH1A1HPGDNPC1NFKB1 | |
| SCHEMBL12264635 | 0.73 | ALDH1A1 (0.46) | RAB9AALDH1A1HPGDNPC1NFKB1 | |
| SCHEMBL3797454 | 0.72 | KMT2A (0.60) | RAB9AALDH1A1HPGDNPC1NFKB1 |
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-107686457-B | A kind of method of two component reactions synthesis 3- thiophenyl -2,4- benzene pentadienoic acid ethyl ester compound of ferrous salt catalysis | 浙江农林大学暨阳学院 | 2019-08-20 | — | — | CN | disclosed |