Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | THRB | P10828 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 4/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.36 |
| ▸ | BACE1 | P56817 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | KAT2B | Q92831 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 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 | |
|---|---|---|---|---|
| SCHEMBL18235928 | 0.81 | GUCY1A1 (0.45) | CYP3A4TP53LMNAALDH1A1MAPT | |
| SCHEMBL21310774 | 0.81 | SMN1; SMN2 (0.41) | SMN1; SMN2TDP1CYP3A4ALOX15TP53 | |
| SCHEMBL15337816 | 0.80 | ALDH1A1 (0.42) | LMNAALDH1A1BACE1FFAR4GAA | |
| SCHEMBL17678181 | 0.79 | LMNA (0.39) | LMNAALDH1A1MAPTBACE1FFAR4 | |
| SCHEMBL2014730 | 0.77 | LMNA (0.50) | SMN1; SMN2TDP1CYP3A4ALOX15TP53 | |
| SCHEMBL18235935 | 0.76 | KDM4E (0.43) | LMNAMAPTMAPK1BACE1GAA | |
| SCHEMBL26378132 | 0.75 | KDM4E (0.47) | SMN1; SMN2TP53LMNAALDH1A1MAPT | |
| SCHEMBL20337678 | 0.75 | KDM4E (0.40) | LMNAALDH1A1KAT2BGAA | |
| SCHEMBL3634658 | 0.74 | TDP1 (0.45) | SMN1; SMN2TDP1CYP3A4ALOX15TP53 | |
| SCHEMBL17263168 | 0.73 | KAT2B (0.59) | CYP3A4ALDH1A1MAPTMAPK1L3MBTL1 |
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-2018125799-A2 | METALLOENZYME INHIBITOR COMPOUNDS | VIAMET PHARMACEUTICALS (BERMUDA), LTD. (BM) | 2018-07-05 | — | — | WO | disclosed |