Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | KDM1A | O60341 | 1/20 | 0.43 |
| ▸ | RCOR1 | Q9UKL0 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 4/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | JAK2 | O60674 | 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 | |
|---|---|---|---|---|
| SCHEMBL13379481 | 0.93 | NPC1 (0.52) | NPC1LMNAKDM4EMEN1KMT2A | |
| SCHEMBL14723747 | 0.85 | NPC1 (0.54) | NPC1LMNAKDM4EMEN1KMT2A | |
| SCHEMBL31188287 | 0.83 | NPC1 (0.57) | NPC1LMNAKDM4EMEN1KMT2A | |
| SCHEMBL13379386 | 0.80 | NPC1 (0.76) | NPC1LMNAKDM4EMEN1KMT2A | |
| SCHEMBL13379525 | 0.80 | KDM4E (0.44) | NPC1LMNAKDM4EPABPC1ALDH1A1 | |
| SCHEMBL26140160 | 0.80 | KDM4E (0.54) | NPC1LMNAKDM4EPABPC1ALDH1A1 | |
| SCHEMBL27420162 | 0.77 | KMT2A (0.47) | NPC1LMNAMEN1KMT2AALDH1A1 | |
| SCHEMBL30877536 | 0.77 | KMT2A (0.47) | NPC1LMNAMEN1KMT2AALDH1A1 | |
| SCHEMBL30745503 | 0.77 | KDM1A (0.51) | NPC1LMNAKDM4EPABPC1ALDH1A1 | |
| SCHEMBL30745512 | 0.77 | KDM1A (0.51) | NPC1LMNAKDM4EPABPC1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2328865-B1 | HEPATITIS C VIRUS INHIBITORS | BRISTOL MYERS SQUIBB CO (US) | 2017-05-31 | — | — | EP | disclosed |