Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | CA3 | P07451 | 1/20 | 0.37 |
| ▸ | CA6 | P23280 | 1/20 | 0.37 |
| ▸ | CA5A | P35218 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.37 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.35 |
| ▸ | KDM1A | O60341 | 2/20 | 0.35 |
| ▸ | MAOB | P27338 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | NFE2L2 | Q16236 | 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 | |
|---|---|---|---|---|
| Piperidine SCHEMBL28021838 | 0.82 | ALDH1A1 (0.50) | SMN1; SMN2ALDH1A1SLC6A2SLC6A4SLC6A3 | |
| Piperidine SCHEMBL28021843 | 0.82 | ALDH1A1 (0.50) | ALDH1A1SLC6A2 | |
| Methane SCHEMBL28949904 | 0.79 | CA3 (0.52) | ALDH1A1CA3CA6CA5ACA9 | |
| Methane SCHEMBL28021409 | 0.79 | CA3 (0.52) | ALDH1A1CA3CA6CA5ACA9 | |
| Piperidine SCHEMBL28021394 | 0.78 | ALDH1A1 (0.41) | SMN1; SMN2ALDH1A1SLC6A2SLC6A4SLC6A3 | |
| Piperidine SCHEMBL28820695 | 0.78 | ALDH1A1 (0.41) | ALDH1A1 | |
| Piperidine SCHEMBL28820787 | 0.78 | ALDH1A1 (0.45) | SMN1; SMN2ALDH1A1SLC6A2SLC6A4SLC6A3 | |
| Piperidine SCHEMBL28021401 | 0.78 | ALDH1A1 (0.45) | ALDH1A1SLC6A2SLC6A4SLC6A3KDM1A | |
| Piperidine SCHEMBL28021852 | 0.77 | ALDH1A1 (0.50) | SMN1; SMN2ALDH1A1CA9SLC6A2SLC6A4 | |
| SCHEMBL29352228 | 0.76 | — | — |
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-104744613-A | Half-metallocene catalyst containing fluorobenzene amidine, preparation method and application thereof | SUZHOU APAC BIOLOG SCIENCE & TECHNOLOGY CO LTD | 2015-07-01 | — | — | CN | claimed |