Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RET | P07949 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL16879006 | 0.80 | RET (0.36) | RETMAPK1 | |
| SCHEMBL27632867 | 0.76 | GSK3B (0.37) | RETHTTHSD17B10 | |
| SCHEMBL17938153 | 0.68 | HTT (0.39) | HTTHSD17B10 | |
| SCHEMBL27332913 | 0.63 | HTT (0.55) | HTTHSD17B10 | |
| SCHEMBL15380562 | 0.63 | MKNK1 (0.44) | HTTHSD17B10 | |
| SCHEMBL27336625 | 0.61 | HTT (0.52) | HTTHSD17B10 | |
| SCHEMBL29275431 | 0.61 | HSD17B10 (0.40) | HTTHSD17B10 | |
| SCHEMBL18978716 | 0.61 | OPRL1 (0.35) | MAPK1 | |
| SCHEMBL5559714 | 0.61 | OPRL1 (0.33) | — | |
| SCHEMBL28002669 | 0.61 | SCN10A (0.41) | RETHSD17B10 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3089973-A1 | HETEROARYL SUBSTITUTED NICOTINAMIDE COMPOUNDS | Bristol-Myers Squibb Company (US) | 2016-11-09 | — | — | EP | disclosed |
| WO-2015103453-A1 | HETEROARYL SUBSTITUTED NICOTINAMIDE COMPOUNDS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2015-07-09 | — | — | WO | disclosed |