Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | GAA | P10253 | 2/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 8/20 | 0.49 |
| ▸ | MAPT | P10636 | 7/20 | 0.49 |
| ▸ | MEN1 | O00255 | 5/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.47 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.47 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 2/20 | 0.46 |
| ▸ | THRB | P10828 | 1/20 | 0.46 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.46 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | ATM | Q13315 | 1/20 | 0.45 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL8758376 | 0.79 | ALDH1A1 (0.46) | ALDH1A1GAAKDM4EKMT2AMAPT | |
| SCHEMBL833353 | 0.77 | ALDH1A1 (0.57) | ALDH1A1GAAKDM4EKMT2AMAPT | |
| SCHEMBL28491071 | 0.77 | KMT2A (0.62) | ALDH1A1GAAKDM4EKMT2AMAPT | |
| SCHEMBL9502855 | 0.77 | CES2 (0.58) | CES2ALDH1A1KDM4EKMT2AMAPT | |
| SCHEMBL11130755 | 0.77 | CES2 (0.58) | CES2ALDH1A1KDM4EKMT2AMAPT | |
| Betanaphthol SCHEMBL29176250 | 0.76 | CES2 (0.56) | CES2ALDH1A1KMT2AMAPTMEN1 | |
| SCHEMBL11169142 | 0.75 | CES2 (0.56) | CES2ALDH1A1KDM4EKMT2AMAPT | |
| SCHEMBL30179515 | 0.75 | CES2 (0.56) | CES2ALDH1A1KDM4EKMT2AMAPT | |
| SCHEMBL23037541 | 0.74 | CES2 (0.55) | CES2ALDH1A1KDM4EKMT2AMAPT | |
| SCHEMBL6960197 | 0.74 | CES2 (0.55) | CES2ALDH1A1KDM4EKMT2AMAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117760990-A | Spectral analysis method for rapidly detecting organic amine | 华侨大学 | 2024-03-26 | — | — | CN | claimed |
| CN-117760990-A | Spectral analysis method for rapidly detecting organic amine | 华侨大学 | 2024-03-26 | — | — | CN | disclosed |