Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | CA9 | Q16790 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 3/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.35 |
| ▸ | GLA | P06280 | 3/20 | 0.35 |
| ▸ | HPGD | P15428 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | GAA | P10253 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL28625790 | 0.79 | PRNP (0.34) | MEN1KMT2A | |
| SCHEMBL28625350 | 0.78 | — | — | |
| SCHEMBL28631570 | 0.77 | CYP2D6 (0.30) | CYP2C19 | |
| SCHEMBL28635582 | 0.76 | TRPA1 (0.32) | TSHR | |
| SCHEMBL23239804 | 0.70 | CA12 (0.49) | CA12CA9CYP1A2CYP2C19NPC1 | |
| SCHEMBL2166868 | 0.67 | ALDH1A1 (0.37) | CA12CA9CYP2C19L3MBTL1KDM4E | |
| SCHEMBL820429 | 0.63 | CA12 (0.49) | CA12CA9CYP1A2CYP2C19NPC1 | |
| SCHEMBL31488657 | 0.63 | CA12 (0.49) | CA12CA9CYP1A2CYP2C19NPC1 | |
| Phenanthrene SCHEMBL28634294 | 0.62 | HSD17B10 (0.86) | CYP1A2CYP2C19ALDH1A1HSD17B10TSHR | |
| SCHEMBL5913910 | 0.62 | ALDH1A1 (0.55) | CA12CA9CYP1A2CYP2C19NPC1 |
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-108250174-B | Naphthopyran compounds and preparation method thereof | 中国科学院兰州化学物理研究所苏州研究院 | 2021-09-10 | — | — | CN | disclosed |