Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.42 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.41 |
| ▸ | ADH1B | P00325 | 1/20 | 0.37 |
| ▸ | ADH1C | P00326 | 1/20 | 0.37 |
| ▸ | ADH1A | P07327 | 1/20 | 0.37 |
| ▸ | ADH7 | P40394 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 3/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | BLM | P54132 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.35 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.35 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.35 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | ESR1 | P03372 | 1/20 | 0.32 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.32 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL20792266 | 0.77 | ALDH1A1 (0.42) | ALDH1A1CYP2A6ADH1BADH1CADH1A | |
| SCHEMBL21082152 | 0.72 | MAPT (0.39) | ALDH1A1CYP2A6ADH1BADH1CADH1A | |
| SCHEMBL226240 | 0.71 | ALDH1A1 (0.41) | ALDH1A1MEN1KMT2AESR1ESR2 | |
| SCHEMBL2595602 | 0.71 | MAPT (0.38) | ALDH1A1LMNAMEN1KMT2AMAPT | |
| SCHEMBL11024215 | 0.69 | ALDH1A1 (0.36) | ALDH1A1CYP2A6ADH1BADH1CADH1A | |
| SCHEMBL23921616 | 0.67 | ALDH1A1 (0.34) | ALDH1A1CYP2A6ADH1BADH1CADH1A | |
| SCHEMBL18638324 | 0.67 | CA4 (0.39) | ALDH1A1CYP2A6ADH1BADH1CADH1A | |
| SCHEMBL10679812 | 0.67 | ALDH1A1 (0.34) | ALDH1A1CYP2A6ADH1BADH1CADH1A | |
| SCHEMBL5146811 | 0.67 | HCAR2 (0.46) | ALDH1A1LMNATHRBMAPTCA2 | |
| SCHEMBL8002913 | 0.67 | ALDH1A1 (0.32) | ALDH1A1ESR1ESR2TSHR |
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-108135782-B | Dental composition | 登特斯普伊德特雷有限公司 | 2022-03-22 | — | — | CN | disclosed |
| CN-108135781-B | Dental composition | 登特斯普伊德特雷有限公司 | 2021-04-16 | — | — | CN | disclosed |