Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.47 |
| ▸ | TSHR | P16473 | 4/20 | 0.47 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.35 |
| ▸ | CACNA1D | Q01668 | 1/20 | 0.35 |
| ▸ | CACNA1S | Q13698 | 1/20 | 0.35 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.35 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.35 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.35 |
| ▸ | JMJD6 | Q6NYC1 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 3/20 | 0.34 |
| ▸ | RAB9A | P51151 | 3/20 | 0.34 |
| ▸ | HTT | P42858 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.33 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.33 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28744988 | 1.00 | ALDH1A1 (0.47) | ALDH1A1TSHRMAPTCACNA1FCACNA1D | |
| SCHEMBL27557396 | 1.00 | ALDH1A1 (0.47) | ALDH1A1TSHRMAPTCACNA1FCACNA1D | |
| SCHEMBL28253923 | 0.81 | PKM (0.43) | ALDH1A1SMN1; SMN2KDM4ETDP1TP53 | |
| SCHEMBL28169153 | 0.81 | PKM (0.43) | ALDH1A1SMN1; SMN2KDM4ETDP1TP53 | |
| SCHEMBL28365859 | 0.80 | TSHR (0.44) | ALDH1A1TSHRMAPTKDM4EHSD17B10 | |
| SCHEMBL28149046 | 0.78 | KDM4E (0.37) | ALDH1A1KDM4EMEN1KMT2ALMNA | |
| SCHEMBL27523171 | 0.78 | KDM4E (0.37) | ALDH1A1KDM4EMEN1KMT2ALMNA | |
| SCHEMBL27562004 | 0.78 | ALDH1A1 (0.50) | ALDH1A1TSHRMAPTNPC1RAB9A | |
| SCHEMBL27534697 | 0.78 | ALDH1A1 (0.50) | ALDH1A1TSHRMAPTNPC1RAB9A | |
| SCHEMBL27702993 | 0.78 | ALDH1A1 (0.50) | ALDH1A1TSHRMAPTNPC1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| EP-3747860-B1 | NOVEL CYCLOHEXANONE BASED PLASTICISERS | BASF SE (DE) | 2023-07-26 | — | — | EP | disclosed |