Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | PPARG | P37231 | 1/20 | 0.49 |
| ▸ | PPARA | Q07869 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | CASP1 | P29466 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 4/20 | 0.48 |
| ▸ | NPC1 | O15118 | 2/20 | 0.48 |
| ▸ | MAPT | P10636 | 5/20 | 0.48 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | FLT1 | P17948 | 2/20 | 0.47 |
| ▸ | FLT4 | P35916 | 2/20 | 0.47 |
| ▸ | KDR | P35968 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.45 |
| ▸ | MEN1 | O00255 | 4/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL21550151 | 0.89 | TP53 (0.47) | SMN1; SMN2HSD17B10PPARGPPARATSHR | |
| SCHEMBL21564944 | 0.86 | SMN1; SMN2 (0.50) | SMN1; SMN2HSD17B10PPARGPPARATSHR | |
| SCHEMBL21351893 | 0.84 | RAB9A (0.43) | SMN1; SMN2PPARGPPARARAB9ANPC1 | |
| SCHEMBL21352079 | 0.84 | HPGD (0.46) | SMN1; SMN2RAB9ANPC1MAPTTP53 | |
| SCHEMBL27774516 | 0.84 | MAPT (0.44) | SMN1; SMN2CASP1RAB9ANPC1MAPT | |
| SCHEMBL21550137 | 0.84 | RAB9A (0.50) | SMN1; SMN2RAB9AMAPTTP53KMT2A | |
| SCHEMBL20157798 | 0.82 | MAPT (0.50) | SMN1; SMN2RAB9ANPC1MAPTSRD5A2 | |
| SCHEMBL4197290 | 0.82 | PPARG (0.54) | SMN1; SMN2HSD17B10PPARGPPARATSHR | |
| SCHEMBL21550126 | 0.82 | RAB9A (0.44) | SMN1; SMN2RAB9ANPC1MAPTTP53 | |
| SCHEMBL23070442 | 0.80 | HPGD (0.53) | SMN1; SMN2RAB9ANPC1MAPTTP53 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2019214399-A1 | BENZO- SEVEN-MEMBERED HETEROCYCLIC COMPOUND, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION THEREOF, AND APPLICATION THEREOF | 罗欣药业(上海)有限公司 (CN) | 2019-11-14 | — | — | WO | disclosed |
| WO-2019214399-A1 | BENZO- SEVEN-MEMBERED HETEROCYCLIC COMPOUND, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION THEREOF, AND APPLICATION THEREOF | 罗欣药业(上海)有限公司 (CN) | 2019-11-14 | — | — | WO | disclosed |