Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.39 |
| ▸ | SCN10A | Q9Y5Y9 | 1/20 | 0.39 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | MGLL | Q99685 | 1/20 | 0.38 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.37 |
| ▸ | CCKAR | P32238 | 1/20 | 0.37 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.36 |
| ▸ | CACNA2D1 | P54289 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | MAPK7 | Q13164 | 1/20 | 0.36 |
| ▸ | SPR | P35270 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL2201986 | 1.00 | KMT2A (0.48) | KMT2ANOTUMKDM4EALDH1A1SCN9A | |
| SCHEMBL2201984 | 1.00 | KMT2A (0.48) | KMT2ANOTUMKDM4EALDH1A1SCN9A | |
| SCHEMBL2202438 | 0.92 | SCN9A (0.40) | KMT2ANOTUMKDM4EALDH1A1SCN9A | |
| SCHEMBL2200534 | 0.92 | SCN9A (0.40) | KMT2ANOTUMKDM4EALDH1A1SCN9A | |
| SCHEMBL2200532 | 0.92 | SCN9A (0.40) | KMT2ANOTUMKDM4EALDH1A1SCN9A | |
| SCHEMBL2202431 | 0.92 | SCN9A (0.40) | KMT2ANOTUMKDM4EALDH1A1SCN9A | |
| SCHEMBL2200538 | 0.92 | SCN9A (0.40) | KMT2ANOTUMKDM4EALDH1A1SCN9A | |
| SCHEMBL2201084 | 0.88 | KMT2A (0.49) | KMT2ANOTUMSCN9ASCN10AHSD11B1 | |
| SCHEMBL2202064 | 0.88 | KMT2A (0.49) | KMT2ANOTUMSCN9ASCN10AHSD11B1 | |
| SCHEMBL2199358 | 0.88 | KMT2A (0.49) | KMT2ANOTUMKDM4EALDH1A1SCN9A |
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 |
|---|---|---|---|---|---|---|---|
| US-7977358-B2 | Pyrazol derivatives | HOFFMANN-LA ROCHE INC. (US) | 2011-07-12 | — | — | US | disclosed |