Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 4/20 | 0.38 |
| ▸ | NOS1 | P29475 | 4/20 | 0.38 |
| ▸ | NOS2 | P35228 | 4/20 | 0.38 |
| ▸ | MAOB | P27338 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | NOS3 | P29474 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.37 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.37 |
| ▸ | LOXL2 | Q9Y4K0 | 2/20 | 0.36 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.36 |
| ▸ | F10 | P00742 | 1/20 | 0.34 |
| ▸ | PNMT | P11086 | 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 | |
|---|---|---|---|---|
| SCHEMBL8289182 | 0.84 | ENPP2 (0.38) | ACHENOS1NOS2MAOBALDH1A1 | |
| SCHEMBL24554358 | 0.77 | ELANE (0.34) | ALDH1A1 | |
| SCHEMBL27938582 | 0.72 | NOS1 (0.46) | ACHENOS1NOS2MAOBALDH1A1 | |
| SCHEMBL2913614 | 0.72 | CYP3A4 (0.58) | ACHENOS1NOS2MAOBALDH1A1 | |
| Hydrochloric Acid SCHEMBL2903507 | 0.71 | CYP3A4 (0.56) | ACHENOS1NOS2MAOBALDH1A1 | |
| SCHEMBL20306055 | 0.71 | TDP1 (0.36) | ALDH1A1SMN1; SMN2CYP3A4NFKB1 | |
| SCHEMBL27638627 | 0.71 | ACHE (0.48) | ACHENOS1NOS2MAOBALDH1A1 | |
| SCHEMBL12901865 | 0.69 | LMNA (0.46) | ACHEALDH1A1CYP3A4 | |
| SCHEMBL1680486 | 0.69 | MAOB (0.45) | ACHENOS1NOS2MAOBALDH1A1 | |
| SCHEMBL27526614 | 0.67 | KMT2A (0.68) | ACHENOS1NOS2MAOBALDH1A1 |
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-2005058298-A2 | FK228 ANALOGS AND THEIR USE AS HDAC-INHIBITORS | WISCONSIN ALUMNI RESEARCH FOUNDATION (US) | 2005-06-30 | — | — | WO | disclosed |