Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.35 |
| ▸ | MEN1 | O00255 | 3/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 3/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.35 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
| ▸ | GFER | P55789 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 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 | |
|---|---|---|---|---|
| SCHEMBL16693082 | 1.00 | CYP2A6 (0.42) | CYP2A6KDM4EALDH1A1L3MBTL1HTT | |
| SCHEMBL16693175 | 0.88 | CYP2A6 (0.51) | CYP2A6KDM4EALDH1A1L3MBTL1HTT | |
| SCHEMBL16687131 | 0.80 | ALDH1A1 (0.40) | KDM4EALDH1A1L3MBTL1HTTPOLB | |
| SCHEMBL16687130 | 0.80 | ALDH1A1 (0.40) | KDM4EALDH1A1L3MBTL1HTTPOLB | |
| SCHEMBL16693174 | 0.77 | CYP2A6 (0.42) | CYP2A6ALDH1A1PTGS1PTGS2PKM | |
| SCHEMBL16693081 | 0.77 | CYP2A6 (0.42) | CYP2A6KDM4EALDH1A1PTGS1PTGS2 | |
| SCHEMBL16693190 | 0.76 | KDM4E (0.37) | KDM4EALDH1A1L3MBTL1HTTPOLB | |
| SCHEMBL424317 | 0.70 | CYP2A6 (0.48) | CYP2A6KDM4EALDH1A1LMNAMAPT | |
| SCHEMBL2166114 | 0.70 | ALDH1A1 (0.50) | KDM4EALDH1A1L3MBTL1HTTPOLB | |
| SCHEMBL1937076 | 0.70 | ALDH1A1 (0.50) | KDM4EALDH1A1L3MBTL1HTTPOLB |
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-2015066371-A1 | SPIRO-OXADIAZOLINE COMPOUNDS AS AGONISTS OF α-7-NICOTINIC ACETYLCHOLINE RECEPTORS | FORUM PHARMACEUTICALS, INC. (US) | 2015-05-07 | — | — | WO | disclosed |