Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.37 |
| ▸ | TSHR | P16473 | 3/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.37 |
| ▸ | DAO | P14920 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 2/20 | 0.33 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.33 |
| ▸ | TNF | P01375 | 1/20 | 0.33 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA7 | P43166 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL22832033 | 0.81 | ALDH1A1 (0.43) | ALDH1A1ALOX15SMN1; SMN2HSD17B10HPGD | |
| SCHEMBL30353759 | 0.81 | ALDH1A1 (0.43) | ALDH1A1ALOX15SMN1; SMN2HSD17B10HPGD | |
| SCHEMBL66253 | 0.79 | ERN1 (0.39) | ALDH1A1ALOX15SMN1; SMN2HSD17B10HPGD | |
| SCHEMBL3287160 | 0.77 | ALDH1A1 (0.42) | ALDH1A1ALOX15SMN1; SMN2HSD17B10HPGD | |
| SCHEMBL31066559 | 0.77 | ALDH1A1 (0.42) | ALDH1A1ALOX15SMN1; SMN2HSD17B10HPGD | |
| SCHEMBL22134195 | 0.77 | ALDH1A1 (0.40) | ALDH1A1ALOX15SMN1; SMN2HSD17B10HPGD | |
| SCHEMBL5594968 | 0.75 | CA1 (0.46) | ALDH1A1ALOX15SMN1; SMN2HSD17B10HPGD | |
| SCHEMBL29658929 | 0.75 | ALDH1A1 (0.40) | ALDH1A1ALOX15SMN1; SMN2HSD17B10HPGD | |
| SCHEMBL2505365 | 0.75 | ALDH1A1 (0.40) | ALDH1A1ALOX15SMN1; SMN2HSD17B10HPGD | |
| SCHEMBL7550602 | 0.75 | HSD17B10 (0.40) | ALDH1A1HSD17B10HPGDMAPK1CYP3A4 |
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-105431427-A | Novel PDE4 inhibitor | MEIJI SEIKA PHARMA CO LTD | 2016-03-23 | — | — | CN | disclosed |