Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | ALPG | P10696 | 2/20 | 0.36 |
| ▸ | PLAA | Q9Y263 | 1/20 | 0.36 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.35 |
| ▸ | FDPS | P14324 | 1/20 | 0.35 |
| ▸ | ALPL | P05186 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL2276496 | 0.86 | SMN1; SMN2 (0.40) | SMN1; SMN2MAPTKMT2AALDH1A1POLB | |
| SCHEMBL300078 | 0.86 | SMN1; SMN2 (0.47) | SMN1; SMN2MAPTKMT2AALDH1A1POLB | |
| SCHEMBL13724404 | 0.84 | SMN1; SMN2 (0.39) | SMN1; SMN2MAPTKMT2AALDH1A1POLB | |
| SCHEMBL4314338 | 0.84 | SMN1; SMN2 (0.39) | SMN1; SMN2MAPTKMT2AALDH1A1POLB | |
| SCHEMBL370634 | 0.82 | SMN1; SMN2 (0.41) | SMN1; SMN2MAPTKMT2AALDH1A1POLB | |
| SCHEMBL25153633 | 0.81 | LPO (0.40) | SMN1; SMN2MAPTALDH1A1NPC1RAB9A | |
| SCHEMBL5518077 | 0.81 | SMN1; SMN2 (0.41) | SMN1; SMN2MAPTKMT2AALDH1A1POLB | |
| SCHEMBL12499907 | 0.81 | MAPT (0.41) | SMN1; SMN2MAPTKMT2AALDH1A1POLB | |
| Hydrochloric Acid SCHEMBL1982420 | 0.80 | SMN1; SMN2 (0.40) | SMN1; SMN2MAPTKMT2AALDH1A1POLB | |
| SCHEMBL12706154 | 0.80 | LPO (0.42) | MAPTKMT2AALDH1A1CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| US-5236952-A | Inhibit the enzyme catechol-O-methyltransferase; for treatment of Parkinson's disease administered with L-dopa | HOFFMANN-LA ROCHE INC. (US) | 1993-08-17 | — | — | US | disclosed |