Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL27902949 | 0.77 | CYP1A2 (0.33) | ALDH1A1MAPK1TDP1MCL1 | |
| SCHEMBL28052202 | 0.74 | PIM1 (0.32) | ALDH1A1MAPK1TDP1 | |
| SCHEMBL27903018 | 0.72 | ALDH1A1 (0.31) | ALDH1A1MAPK1TDP1 | |
| SCHEMBL27870365 | 0.72 | ERN1 (0.31) | ALDH1A1MAPK1TDP1 | |
| SCHEMBL27771525 | 0.72 | NQO1 (0.32) | ALDH1A1MAPK1TDP1 | |
| SCHEMBL28007109 | 0.70 | — | — | |
| SCHEMBL28105938 | 0.66 | — | — | |
| SCHEMBL28009648 | 0.66 | — | — | |
| SCHEMBL27577308 | 0.64 | ALDH1A1 (0.36) | ALDH1A1MAPK1TDP1MCL1 | |
| SCHEMBL8620985 | 0.64 | ALDH1A1 (0.41) | ALDH1A1MAPK1TDP1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107935804-A | A kind of preparation method of 1,2,3,4 durol | 杭州盛弗泰新材料科技有限公司 | 2018-04-20 | — | — | CN | claimed |
| CN-107935804-A | A kind of preparation method of 1,2,3,4 durol | 杭州盛弗泰新材料科技有限公司 | 2018-04-20 | — | — | CN | disclosed |
| CN-101663309-B | Process for preparing substituted pentacenes | MERCK PATENT GMBH | 2013-08-14 | — | — | CN | disclosed |
| CN-101663309-A | Process for preparing substituted pentacenes | MERCK PATENT GMBH | 2010-03-03 | — | — | CN | disclosed |