Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.55 |
| ▸ | MAPT | P10636 | 5/20 | 0.55 |
| ▸ | HPGD | P15428 | 4/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.55 |
| ▸ | NPC1 | O15118 | 3/20 | 0.52 |
| ▸ | RAB9A | P51151 | 3/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.52 |
| ▸ | GAA | P10253 | 2/20 | 0.52 |
| ▸ | TSHR | P16473 | 2/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.52 |
| ▸ | APP | P05067 | 2/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | PHLPP2 | Q6ZVD8 | 1/20 | 0.45 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.43 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.43 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.43 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL27997557 | 1.00 | ALDH1A1 (0.55) | ALDH1A1MAPTHPGDKDM4ENPC1 | |
| SCHEMBL12380037 | 0.94 | ALDH1A1 (0.60) | ALDH1A1MAPTHPGDKDM4ENPC1 | |
| SCHEMBL12380026 | 0.94 | ALDH1A1 (0.60) | ALDH1A1MAPTHPGDKDM4ENPC1 | |
| SCHEMBL12998144 | 0.90 | ALDH1A1 (0.59) | ALDH1A1MAPTHPGDKDM4ENPC1 | |
| SCHEMBL1506126 | 0.88 | ALDH1A1 (0.65) | ALDH1A1MAPTHPGDKDM4ENPC1 | |
| SCHEMBL18579629 | 0.88 | ALDH1A1 (0.56) | ALDH1A1MAPTHPGDKDM4ENPC1 | |
| SCHEMBL3841164 | 0.87 | SERPINE1 (0.53) | ALDH1A1MAPTNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL10383286 | 0.87 | SERPINE1 (0.53) | ALDH1A1MAPTNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL674457 | 0.87 | SERPINE1 (0.53) | ALDH1A1MAPTNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL665153 | 0.87 | SERPINE1 (0.53) | ALDH1A1MAPTNPC1RAB9ASMN1; SMN2 |
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-104292445-B | A kind of preparation method of macromole p-(dimethylamino)-benzoic acid ester type compound | 山东久日化学科技有限公司 | 2016-11-16 | — | — | CN | disclosed |