Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | STAT3 | P40763 | 1/20 | 0.60 |
| ▸ | NQO1 | P15559 | 2/20 | 0.55 |
| ▸ | POR | P16435 | 2/20 | 0.55 |
| ▸ | MALT1 | Q9UDY8 | 2/20 | 0.54 |
| ▸ | ACHE | P22303 | 1/20 | 0.44 |
| ▸ | CLK1 | P49759 | 1/20 | 0.44 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.44 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.44 |
| ▸ | IDO1 | P14902 | 3/20 | 0.43 |
| ▸ | MAOB | P27338 | 4/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.41 |
| ▸ | AR | P10275 | 1/20 | 0.41 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.41 |
| ▸ | METAP1 | P53582 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL29199282 | 0.94 | STAT3 (0.67) | STAT3NQO1PORMALT1ACHE | |
| SCHEMBL3329494 | 0.83 | STAT3 (0.49) | STAT3NQO1PORMALT1ACHE | |
| SCHEMBL29135718 | 0.81 | STAT3 (0.53) | STAT3NQO1PORMALT1CLK1 | |
| Hydrochloric Acid SCHEMBL29135720 | 0.80 | STAT3 (0.52) | STAT3NQO1PORMALT1CLK1 | |
| SCHEMBL29135713 | 0.80 | STAT3 (0.53) | STAT3MALT1IDO1MAOBCYP19A1 | |
| SCHEMBL10525508 | 0.78 | IDO1 (0.44) | STAT3NQO1PORMALT1ACHE | |
| SCHEMBL8043779 | 0.77 | STAT3 (0.52) | STAT3NQO1PORMALT1ACHE | |
| SCHEMBL103969 | 0.77 | STAT3 (0.52) | STAT3NQO1PORMALT1ACHE | |
| SCHEMBL30662473 | 0.77 | STAT3 (0.52) | STAT3NQO1PORMALT1ACHE | |
| SCHEMBL29199273 | 0.75 | STAT3 (1.00) | STAT3ACHEMAOBAR |
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-117105894-A | Preparation method and application of cryptotanshinone compound | 中国人民解放军海军军医大学 | 2023-11-24 | — | — | CN | disclosed |