Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 4/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | LMNA | P02545 | 3/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.45 |
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.45 |
| ▸ | TLR9 | Q9NR96 | 2/20 | 0.45 |
| ▸ | XBP1 | P17861 | 1/20 | 0.45 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | MITF | O75030 | 1/20 | 0.39 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.35 |
| ▸ | HSPD1 | P10809 | 1/20 | 0.35 |
| ▸ | HSPE1 | P61604 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL15067937 | 0.81 | GRIN2D (0.43) | MAPTALDH1A1LMNANPSR1NPC1 | |
| SCHEMBL20155561 | 0.79 | ALDH1A1 (0.40) | MAPTALDH1A1LMNANPSR1NPC1 | |
| SCHEMBL31440040 | 0.71 | GAA (0.46) | MAPTALDH1A1LMNANPSR1NPC1 | |
| SCHEMBL15964511 | 0.71 | LMNA (0.36) | MAPTALDH1A1LMNANPSR1RAB9A | |
| SCHEMBL20704658 | 0.68 | BRD4 (0.33) | MAPTALDH1A1KDM4EMEN1KMT2A | |
| SCHEMBL6286816 | 0.68 | GAA (0.46) | MAPTALDH1A1LMNANPSR1NPC1 | |
| SCHEMBL2070905 | 0.68 | ALDH1A1 (0.44) | MAPTALDH1A1LMNANPSR1HTT | |
| SCHEMBL20545386 | 0.67 | KDM4E (0.44) | MAPTALDH1A1LMNANPSR1NPC1 | |
| SCHEMBL23229161 | 0.66 | ALDH1A1 (0.50) | MAPTALDH1A1TSHRPTGER4MEN1 | |
| SCHEMBL19869855 | 0.65 | L3MBTL1 (0.54) | MAPTALDH1A1TLR9MEN1KMT2A |
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-2018086604-A1 | NITROGEN-CONTAINING HETEROCYCLIC COMPOUNDS, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION THEREOF, AND APPLICATIONS THEREOF | 山东罗欣药业集团股份有限公司 | 2018-05-17 | — | — | WO | disclosed |