Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B2 | P37059 | 1/20 | 0.41 |
| ▸ | S1PR2 | O95136 | 1/20 | 0.39 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.39 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.39 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.39 |
| ▸ | CRHR1 | P34998 | 2/20 | 0.39 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 8/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.38 |
| ▸ | HPGD | P15428 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 3/20 | 0.38 |
| ▸ | RAB9A | P51151 | 3/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 3/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL29288168 | 1.00 | HSD17B2 (0.41) | HSD17B2S1PR2S1PR4LMNAHTT | |
| SCHEMBL805163 | 0.75 | ALDH1A1 (0.46) | S1PR2S1PR4LMNAHTTNPSR1 | |
| SCHEMBL13826533 | 0.75 | ALDH1A1 (0.49) | S1PR2S1PR4LMNAHTTNPSR1 | |
| SCHEMBL27990410 | 0.75 | HTT (0.46) | HSD17B2S1PR2S1PR4LMNAHTT | |
| SCHEMBL13719298 | 0.72 | MAPT (0.45) | S1PR2S1PR4LMNAHTTNPSR1 | |
| SCHEMBL9094561 | 0.71 | LMNA (0.45) | LMNAHTTCRHR1MAPTALDH1A1 | |
| SCHEMBL19840842 | 0.70 | SLC2A1 (0.39) | HSD17B2S1PR2S1PR4LMNAHTT | |
| SCHEMBL27990140 | 0.70 | NPC1 (0.46) | LMNAHTTMAPTALDH1A1HPGD | |
| SCHEMBL31073656 | 0.69 | KDM4E (0.52) | LMNAHTTNPSR1SLC2A1MAPT | |
| SCHEMBL6875538 | 0.68 | SLC2A1 (0.43) | HSD17B2LMNAHTTSLC2A1SOS1 |
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-108947912-B | Neddylation pathway targeted anti-tumor compound | 中国人民解放军总医院 | 2021-10-01 | — | — | CN | disclosed |