Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | RAB9A | P51151 | 5/20 | 0.47 |
| ▸ | GAA | P10253 | 4/20 | 0.47 |
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 7/20 | 0.47 |
| ▸ | MEN1 | O00255 | 6/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 4/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | NAMPT | P43490 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 2/20 | 0.44 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL8535567 | 1.00 | SMN1; SMN2 (0.49) | SMN1; SMN2ALDH1A1RAB9AGAANPC1 | |
| SCHEMBL9607506 | 0.86 | EPHX2 (0.45) | SMN1; SMN2ALDH1A1RAB9ANPC1POLB | |
| SCHEMBL9607091 | 0.86 | EPHX2 (0.45) | SMN1; SMN2ALDH1A1RAB9ANPC1POLB | |
| SCHEMBL9298448 | 0.85 | GAA (0.51) | SMN1; SMN2ALDH1A1RAB9AGAANPC1 | |
| SCHEMBL3858960 | 0.85 | GAA (0.51) | SMN1; SMN2ALDH1A1RAB9AGAANPC1 | |
| SCHEMBL2549625 | 0.85 | GAA (0.51) | SMN1; SMN2ALDH1A1RAB9AGAANPC1 | |
| SCHEMBL8515513 | 0.82 | SMN1; SMN2 (0.48) | SMN1; SMN2ALDH1A1RAB9AGAANPC1 | |
| SCHEMBL8515514 | 0.82 | SMN1; SMN2 (0.48) | SMN1; SMN2ALDH1A1RAB9AGAANPC1 | |
| SCHEMBL28561885 | 0.77 | CYP19A1 (0.54) | SMN1; SMN2ALDH1A1RAB9AGAANPC1 | |
| SCHEMBL12891827 | 0.75 | NPC1 (0.59) | SMN1; SMN2ALDH1A1RAB9ANPC1KMT2A |
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-2012069856-A1 | ANTIMALARIAL COMPOUNDS | LIVERPOOL SCHOOL OF TROPICAL MEDICINE (GB) | 2012-05-31 | — | — | WO | disclosed |