Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.38 |
| ▸ | SCN10A | Q9Y5Y9 | 1/20 | 0.38 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.37 |
| ▸ | MGLL | Q99685 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | MAPK7 | Q13164 | 1/20 | 0.36 |
| ▸ | CCR5 | P51681 | 1/20 | 0.36 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.36 |
| ▸ | SLC5A1 | P13866 | 2/20 | 0.36 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.36 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.35 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.35 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
| ▸ | CCR1 | P32246 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL2201797 | 1.00 | KMT2A (0.48) | KMT2ASCN9ASCN10AHSD11B1MGLL | |
| SCHEMBL4357620 | 0.93 | KMT2A (0.42) | KMT2ASCN9ASCN10AHSD11B1MGLL | |
| SCHEMBL2203381 | 0.92 | KMT2A (0.47) | KMT2ASCN9ASCN10AHSD11B1MGLL | |
| SCHEMBL2201167 | 0.92 | KMT2A (0.47) | KMT2ASCN9ASCN10AHSD11B1MGLL | |
| SCHEMBL2201175 | 0.92 | KMT2A (0.47) | KMT2ASCN9ASCN10AHSD11B1MGLL | |
| SCHEMBL2202721 | 0.89 | KMT2A (0.49) | KMT2ASCN9ASCN10AHSD11B1MGLL | |
| SCHEMBL2202694 | 0.87 | KMT2A (0.44) | KMT2ASCN9ASCN10AHSD11B1MAPT | |
| SCHEMBL2204481 | 0.87 | KMT2A (0.44) | KMT2ASCN9ASCN10AHSD11B1MAPT | |
| SCHEMBL12429653 | 0.85 | KMT2A (0.47) | KMT2ASCN9ASCN10AHSD11B1MAPT | |
| SCHEMBL2202531 | 0.85 | KMT2A (0.46) | KMT2ASCN9ASCN10AHSD11B1MAPT |
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 |