Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 5/20 | 0.41 |
| ▸ | CES2 | O00748 | 4/20 | 0.41 |
| ▸ | TSHR | P16473 | 4/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.41 |
| ▸ | NAPRT | Q6XQN6 | 2/20 | 0.41 |
| ▸ | DAO | P14920 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 4/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | PARP1 | P09874 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
| ▸ | BLM | P54132 | 1/20 | 0.38 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL17163820 | 0.82 | CES1 (0.41) | CES1CES2TSHRALDH1A1ALOX15 | |
| SCHEMBL1130961 | 0.78 | CES2 (0.48) | CES1CES2TSHRALDH1A1ALOX15 | |
| SCHEMBL6435768 | 0.76 | CES1 (0.48) | CES1CES2TSHRALDH1A1ALOX15 | |
| SCHEMBL5146804 | 0.74 | HPGD (0.36) | CES1CES2TSHRALDH1A1ALOX15 | |
| SCHEMBL28533098 | 0.72 | CES1 (0.46) | CES1ALDH1A1MAPTSMN1; SMN2ESR1 | |
| SCHEMBL10864802 | 0.72 | CES2 (0.43) | CES1CES2TSHRALDH1A1MAPT | |
| SCHEMBL16706156 | 0.72 | ESR1 (0.44) | CES1CES2TSHRALDH1A1ALOX15 | |
| SCHEMBL28992408 | 0.71 | CES1 (0.41) | CES1CES2TSHRALDH1A1ALOX15 | |
| SCHEMBL14777393 | 0.71 | NR1H2 (0.39) | ALDH1A1MAPTTDP1CA12CA1 | |
| SCHEMBL23532473 | 0.68 | CES2 (0.46) | CES1CES2TDP1POLBCA1 |
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 |