Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.46 |
| ▸ | CHRNG | P07510 | 1/20 | 0.46 |
| ▸ | CHRNB1 | P11230 | 1/20 | 0.46 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.46 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.46 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.46 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.46 |
| ▸ | CHRND | Q07001 | 1/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | GRM7 | Q14831 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 3/20 | 0.43 |
| ▸ | KMO | O15229 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | ADCY8 | P40145 | 1/20 | 0.41 |
| ▸ | ADCY1 | Q08828 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL24209020 | 1.00 | ALDH1A1 (0.47) | ALDH1A1CHRNA1CHRNGCHRNB1CHRNB2 | |
| SCHEMBL4951622 | 0.87 | KMO (0.57) | ALDH1A1ALOX15CREBBPKMT2ANPC1 | |
| SCHEMBL4946903 | 0.85 | KMO (0.54) | ALDH1A1ALOX15CREBBPKMT2ANPC1 | |
| SCHEMBL28610604 | 0.83 | ALDH1A1 (0.47) | ALDH1A1CHRNA1CHRNGCHRNB1CHRNB2 | |
| SCHEMBL18459668 | 0.83 | SMN1; SMN2 (0.52) | ALDH1A1CHRNB2CHRNA4KMT2ANPC1 | |
| SCHEMBL6139695 | 0.82 | ALDH1A1 (0.46) | ALDH1A1CHRNA1CHRNGCHRNB1CHRNB2 | |
| SCHEMBL11377191 | 0.82 | PRKCI (0.46) | ALDH1A1CHRNA1CHRNGCHRNB1CHRNB2 | |
| SCHEMBL11675275 | 0.82 | ALDH1A1 (0.46) | ALDH1A1CHRNA1CHRNGCHRNB1CHRNB2 | |
| SCHEMBL11675460 | 0.82 | PRKCI (0.46) | ALDH1A1CHRNA1CHRNGCHRNB1CHRNB2 | |
| SCHEMBL11369747 | 0.82 | ALDH1A1 (0.46) | ALDH1A1CHRNA1CHRNGCHRNB1CHRNB2 |
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-109020790-B | Preparation method of 4-naphthenic acetophenone derivative | 苏州大学 | 2021-07-27 | — | — | CN | disclosed |