Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.39 |
| ▸ | HPGD | P15428 | 3/20 | 0.39 |
| ▸ | NPC1 | O15118 | 4/20 | 0.36 |
| ▸ | RAB9A | P51151 | 4/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | PAX8 | Q06710 | 2/20 | 0.36 |
| ▸ | JAK2 | O60674 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 1/20 | 0.35 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.34 |
| ▸ | APP | P05067 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.33 |
| ▸ | MAPT | P10636 | 4/20 | 0.33 |
| ▸ | LMNA | P02545 | 3/20 | 0.33 |
| ▸ | SLC16A3 | O15427 | 3/20 | 0.33 |
| ▸ | MEN1 | O00255 | 3/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | SLC16A1 | P53985 | 2/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL20208875 | 0.90 | ALDH1A1 (0.38) | ALDH1A1SMN1; SMN2HPGDNPC1RAB9A | |
| SCHEMBL29705980 | 0.90 | ALDH1A1 (0.38) | ALDH1A1SMN1; SMN2HPGDNPC1RAB9A | |
| SCHEMBL21860450 | 0.81 | MAOB (0.40) | ALDH1A1SMN1; SMN2HPGDNPC1RAB9A | |
| SCHEMBL12722008 | 0.78 | TDP1 (0.44) | ALDH1A1HPGDNPC1RAB9AHTT | |
| SCHEMBL13721235 | 0.78 | ALDH1A1 (0.48) | ALDH1A1HPGDNPC1RAB9AHTT | |
| SCHEMBL10039954 | 0.78 | ALDH1A1 (0.48) | ALDH1A1HPGDNPC1RAB9AHTT | |
| SCHEMBL22812841 | 0.78 | ALDH1A1 (0.48) | ALDH1A1HPGDNPC1RAB9AHTT | |
| SCHEMBL13721286 | 0.78 | ALDH1A1 (0.48) | ALDH1A1HPGDNPC1RAB9AHTT | |
| SCHEMBL13886460 | 0.78 | ALDH1A1 (0.48) | ALDH1A1HPGDNPC1RAB9AHTT | |
| SCHEMBL7169458 | 0.78 | ALDH1A1 (0.48) | ALDH1A1HPGDNPC1RAB9AHTT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017210072-A1 | ELECTROACTIVE COMPOUNDS | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 2017-12-07 | — | — | WO | disclosed |