Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 6/20 | 0.49 |
| ▸ | RAB9A | P51151 | 5/20 | 0.49 |
| ▸ | HTT | P42858 | 2/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.47 |
| ▸ | HMGCR | P04035 | 1/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL7639642 | 0.86 | CYP2C19 (0.55) | NPC1RAB9AHTTHSD17B10ALDH1A1 | |
| SCHEMBL5730634 | 0.84 | ALDH1A1 (0.62) | NPC1RAB9AHTTHSD17B10ALDH1A1 | |
| SCHEMBL687106 | 0.84 | KDM4E (0.53) | NPC1RAB9AHTTHSD17B10ALDH1A1 | |
| SCHEMBL27457535 | 0.83 | ALOX5 (0.48) | ALDH1A1MEN1KMT2A | |
| SCHEMBL11070204 | 0.82 | KDM4E (0.54) | NPC1RAB9AHTTHSD17B10ALDH1A1 | |
| SCHEMBL10822663 | 0.82 | KDM4E (0.49) | NPC1RAB9AHTTHSD17B10ALDH1A1 | |
| SCHEMBL11013421 | 0.82 | KDM4E (0.49) | NPC1RAB9AHTTHSD17B10ALDH1A1 | |
| SCHEMBL2260356 | 0.82 | NPC1 (0.68) | NPC1RAB9AHTTALDH1A1CYP3A4 | |
| SCHEMBL5914630 | 0.82 | SMN1; SMN2 (0.63) | NPC1RAB9AHTTALDH1A1HPGD | |
| SCHEMBL3483717 | 0.82 | NPC1 (0.49) | NPC1RAB9AHTTALDH1A1CYP3A4 |
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-108135175-A | Bicyclic compounds and their use for inhibition of SUV39H2 | 肿瘤疗法科学股份有限公司 | 2018-06-08 | — | — | CN | disclosed |