Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 9/20 | 0.44 |
| ▸ | MAPT | P10636 | 4/20 | 0.44 |
| ▸ | HPGD | P15428 | 3/20 | 0.44 |
| ▸ | LMNA | P02545 | 3/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.44 |
| ▸ | CASP1 | P29466 | 1/20 | 0.44 |
| ▸ | CASP7 | P55210 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 3/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.43 |
| ▸ | AKT1 | P31749 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 2/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | KMO | O15229 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8203169 | 0.84 | KDM4E (0.48) | ALDH1A1KDM4EMAPTMEN1KMT2A | |
| SCHEMBL31365399 | 0.81 | MEN1 (0.58) | MAPTLMNACASP1MEN1KMT2A | |
| SCHEMBL2111127 | 0.81 | ALDH1A1 (0.44) | ALDH1A1KDM4EMAPTHPGDLMNA | |
| SCHEMBL17624437 | 0.79 | HRH4 (0.46) | ALDH1A1KDM4EMAPTHPGDLMNA | |
| SCHEMBL2913101 | 0.78 | KDM4E (0.41) | ALDH1A1KDM4EMAPTHPGDLMNA | |
| SCHEMBL2910573 | 0.78 | KDM4E (0.41) | ALDH1A1KDM4EMAPTHPGDLMNA | |
| SCHEMBL2910571 | 0.78 | KDM4E (0.41) | ALDH1A1KDM4EMAPTHPGDLMNA | |
| SCHEMBL2809323 | 0.78 | HSP90AA1 (0.52) | ALDH1A1KDM4EMAPTKMT2APOLB | |
| SCHEMBL19498194 | 0.75 | GAA (0.43) | ALDH1A1KDM4EMAPTHPGDLMNA | |
| SCHEMBL13223166 | 0.74 | KDM4E (0.39) | ALDH1A1KDM4EMAPTHPGDLMNA |
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-2008033389-A2 | MACROCYCLIC HCV INHIBITORS AND THEIR USES | NOVARTIS AG (CH) | 2008-03-20 | — | — | WO | disclosed |