Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 6/20 | 0.68 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.68 |
| ▸ | LMNA | P02545 | 3/20 | 0.68 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.65 |
| ▸ | TP53 | P04637 | 1/20 | 0.65 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.65 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.61 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.61 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.58 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.58 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.55 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.55 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.55 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.55 |
| ▸ | CFTR | P13569 | 1/20 | 0.55 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.54 |
| ▸ | POLB | P06746 | 2/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL6398624 | 0.90 | ALDH1A1 (0.87) | TSHRALDH1A1LMNACYP3A4TP53 | |
| SCHEMBL6402299 | 0.90 | ALDH1A1 (0.87) | TSHRALDH1A1LMNACYP3A4TP53 | |
| SCHEMBL6400499 | 0.90 | ALDH1A1 (0.87) | TSHRALDH1A1LMNACYP3A4TP53 | |
| SCHEMBL6402272 | 0.90 | ALDH1A1 (0.87) | TSHRALDH1A1LMNACYP3A4TP53 | |
| SCHEMBL6400270 | 0.90 | ALDH1A1 (0.87) | TSHRALDH1A1LMNACYP3A4TP53 | |
| SCHEMBL1663823 | 0.90 | ALDH1A1 (0.87) | TSHRALDH1A1LMNACYP3A4TP53 | |
| SCHEMBL6405091 | 0.90 | ALDH1A1 (0.87) | TSHRALDH1A1LMNACYP3A4TP53 | |
| SCHEMBL6404658 | 0.90 | ALDH1A1 (0.87) | TSHRALDH1A1LMNACYP3A4TP53 | |
| SCHEMBL6405746 | 0.90 | ALDH1A1 (0.87) | TSHRALDH1A1LMNACYP3A4TP53 | |
| SCHEMBL6407671 | 0.90 | ALDH1A1 (0.87) | TSHRALDH1A1LMNACYP3A4TP53 |
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-115040548-A | Halocynthia Roretzi antitumor extract and preparation method and application thereof | 中国海洋大学 | 2022-09-13 | — | — | CN | disclosed |