Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 1/20 | 0.37 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.37 |
| ▸ | KDR | P35968 | 1/20 | 0.37 |
| ▸ | PARP1 | P09874 | 2/20 | 0.35 |
| ▸ | IDO1 | P14902 | 7/20 | 0.35 |
| ▸ | ECE1 | P42892 | 1/20 | 0.34 |
| ▸ | IKBKB | O14920 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | METAP2 | P50579 | 1/20 | 0.32 |
| ▸ | CHUK | O15111 | 1/20 | 0.32 |
| ▸ | NNMT | P40261 | 1/20 | 0.32 |
| ▸ | CDC7 | O00311 | 2/20 | 0.31 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.31 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL27186153 | 0.89 | ECE1 (0.40) | EGFRFGFR1KDRIDO1ECE1 | |
| SCHEMBL27187216 | 0.88 | EGFR (0.39) | EGFRFGFR1KDRIDO1ECE1 | |
| SCHEMBL30853319 | 0.72 | BRD4 (0.37) | PARP1IKBKB | |
| SCHEMBL30853309 | 0.71 | ALDH1A1 (0.34) | PARP1GAANNMTHSP90AA1 | |
| SCHEMBL30853331 | 0.68 | JAK2 (0.39) | GAA | |
| SCHEMBL30853312 | 0.66 | PARP1 (0.31) | PARP1 | |
| SCHEMBL30853351 | 0.66 | PARP1 (0.43) | PARP1GAANNMT | |
| SCHEMBL27186991 | 0.64 | HSD17B10 (0.50) | — | |
| SCHEMBL30853352 | 0.63 | KDM4E (0.40) | PARP1 | |
| SCHEMBL27323238 | 0.63 | IDO1 (0.59) | PARP1IDO1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-117651701-A | Novel substituted bicyclic aza heterocycles as SOS1 inhibitors | 唯久生物技术(苏州)有限公司 | 2024-03-05 | — | — | CN | disclosed |