Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.46 |
| ▸ | MEN1 | O00255 | 3/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 7/20 | 0.43 |
| ▸ | KDM1A | O60341 | 1/20 | 0.43 |
| ▸ | BACE1 | P56817 | 1/20 | 0.43 |
| ▸ | BACE2 | Q9Y5Z0 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | CA4 | P22748 | 1/20 | 0.42 |
| ▸ | CA7 | P43166 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | AGTR1 | P30556 | 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 | |
|---|---|---|---|---|
| SCHEMBL14939745 | 0.81 | CA1 (0.51) | KMT2AMEN1GAAMAPTALDH1A1 | |
| SCHEMBL14939005 | 0.81 | KMT2A (0.49) | KMT2AMEN1GAAMAPTKDM1A | |
| SCHEMBL14939759 | 0.78 | NPSR1 (0.51) | KMT2AMEN1GAAMAPTBACE1 | |
| SCHEMBL14938923 | 0.76 | MAPT (0.43) | GAAMAPTBACE1BACE2ALDH1A1 | |
| SCHEMBL14940053 | 0.75 | S100A4 (0.43) | KMT2AGAAMAPTBACE1ALDH1A1 | |
| SCHEMBL14191205 | 0.71 | ESR1 (0.47) | KMT2AMEN1GAAMAPTKDM1A | |
| SCHEMBL13949547 | 0.71 | CMA1 (0.51) | KMT2AMEN1GAAMAPTALDH1A1 | |
| SCHEMBL14940276 | 0.71 | PPIB (0.43) | KMT2AMEN1GAAMAPTKDM1A | |
| SCHEMBL30683805 | 0.71 | MAPT (0.50) | KMT2AMEN1GAAMAPTBACE1 | |
| SCHEMBL29155435 | 0.71 | MAPT (0.50) | KMT2AMEN1GAAMAPTBACE1 |
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-2013068785-A1 | INDANONE AND INDANDIONE DERIVATIVES AND HETEROCYCLIC ANALOGS | ACTELION PHARMACEUTICALS LTD (CH) | 2013-05-16 | — | — | WO | disclosed |