Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APP | P05067 | 2/20 | 0.50 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.49 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.47 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.47 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.47 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | EGFR | P00533 | 2/20 | 0.44 |
| ▸ | CDK1 | P06493 | 1/20 | 0.44 |
| ▸ | SRC | P12931 | 1/20 | 0.44 |
| ▸ | TMIGD3 | P0DMS9 | 1/20 | 0.44 |
| ▸ | HTR2C | P28335 | 1/20 | 0.44 |
| ▸ | HTR2B | P41595 | 1/20 | 0.44 |
| ▸ | DHFR | P00374 | 1/20 | 0.44 |
| ▸ | FYN | P06241 | 1/20 | 0.44 |
| ▸ | MAOB | P27338 | 1/20 | 0.44 |
| ▸ | HTR6 | P50406 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL22448311 | 0.84 | DHFR (0.48) | APPMAP4K4HDAC3HDAC1HDAC2 | |
| SCHEMBL22448315 | 0.83 | DHFR (0.59) | APPEGFRDHFRBACE1 | |
| SCHEMBL20874965 | 0.75 | APP (0.48) | APPMAP4K4HDAC3HDAC1HDAC2 | |
| SCHEMBL6700054 | 0.74 | CHRM2 (0.55) | APPHDAC3HDAC1HDAC2HDAC6 | |
| SCHEMBL632217 | 0.74 | CHRM2 (0.55) | APPHDAC3HDAC1HDAC2HDAC6 | |
| SCHEMBL21303629 | 0.74 | CDC7 (0.51) | APPMAP4K4HDAC3HDAC1HDAC2 | |
| SCHEMBL11389411 | 0.73 | HDAC3 (0.49) | HDAC3HDAC1HDAC2HDAC6FYN | |
| SCHEMBL22440204 | 0.73 | CDC7 (0.56) | HDAC3HDAC1HDAC2HDAC6EGFR | |
| SCHEMBL11510712 | 0.73 | HDAC4 (0.54) | HDAC3HDAC1HDAC2HDAC6MAOB | |
| SCHEMBL1196472 | 0.73 | MAOB (0.56) | APPHDAC6MAOB |
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 |
|---|---|---|---|---|---|---|---|
| EP-3589632-B1 | NOVEL INHIBITORS OF BACTERIAL GLUTAMINYL CYCLASES FOR USE IN THE TREATMENT OF PERIODONTAL AND RELATED DISEASES | Fraunhofer-Gesellschaft zur Förderung der Angewandten Forschung Ev (DE) | 2020-09-23 | — | — | EP | disclosed |