Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RET | P07949 | 3/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | ATR | Q13535 | 1/20 | 0.31 |
| ▸ | RPS6KB1 | P23443 | 3/20 | 0.30 |
| ▸ | AKT1 | P31749 | 3/20 | 0.30 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.30 |
| ▸ | FEN1 | P39748 | 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 | |
|---|---|---|---|---|
| SCHEMBL16879003 | 0.80 | RET (0.32) | RETMAPK1 | |
| SCHEMBL27965089 | 0.73 | PARP1 (0.42) | RET | |
| SCHEMBL26618870 | 0.66 | IDO1 (0.39) | RETATRALOX5APFEN1 | |
| SCHEMBL9206473 | 0.65 | CNR1 (0.36) | RETATRALOX5APFEN1 | |
| SCHEMBL15380562 | 0.63 | MKNK1 (0.44) | — | |
| SCHEMBL7511256 | 0.62 | MAPT (0.41) | ALOX5APFEN1 | |
| SCHEMBL9207129 | 0.61 | MAPT (0.40) | ALOX5APFEN1 | |
| SCHEMBL9207313 | 0.61 | MAPT (0.40) | ALOX5APFEN1 | |
| SCHEMBL31668887 | 0.61 | HTT (0.43) | ALOX5APFEN1 | |
| SCHEMBL7718372 | 0.61 | KDM4E (0.43) | MAPK1 |
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 |