Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 15/20 | 0.38 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | GLA | P06280 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | AR | P10275 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9269944 | 0.84 | EGFR (0.49) | ACHEPTGS2PTGS1RAB9AKDM4E | |
| SCHEMBL9265538 | 0.83 | PTGS2 (0.52) | ACHEPTGS2PTGS1GAA | |
| SCHEMBL9264843 | 0.83 | PTGS2 (0.52) | ACHEPTGS2PTGS1 | |
| SCHEMBL9268153 | 0.82 | PTGS2 (0.45) | ACHEPTGS2PTGS1 | |
| SCHEMBL9268345 | 0.80 | PTGS2 (0.55) | ACHEPTGS2PTGS1MAPT | |
| SCHEMBL9256975 | 0.80 | PTGS2 (0.60) | PTGS2PTGS1 | |
| SCHEMBL9266183 | 0.80 | PTGS2 (0.55) | ACHEPTGS2PTGS1 | |
| SCHEMBL9282952 | 0.80 | PTGS2 (0.53) | ACHEPTGS2PTGS1 | |
| SCHEMBL9271420 | 0.79 | MAPT (0.51) | PTGS2RAB9AKDM4EALDH1A1GLA | |
| SCHEMBL9260602 | 0.77 | ACHE (0.47) | ACHEPTGS2MAPT |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5403934-A | Heterocyclic compounds | BURROUGHS WELLCOME CO. (US) | 1995-04-04 | — | — | US | disclosed |
| WO-1991013873-A1 | HETEROCYCLIC COMPOUNDS | THE WELLCOME FOUNDATION LIMITED (GB) | 1991-09-19 | — | — | WO | disclosed |
| EP-0447164-A1 | Heterocyclic compounds | THE WELLCOME FOUNDATION LIMITED (GB) | 1991-09-18 | — | — | EP | disclosed |