Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 4/20 | 0.40 |
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | HTR7 | P34969 | 2/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.40 |
| ▸ | PTGS2 | P35354 | 9/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL5170853 | 0.90 | HTR7 (0.46) | RAB9ANPC1SMN1; SMN2LMNAMAPT | |
| SCHEMBL4186638 | 0.86 | RAB9A (0.44) | RAB9ANPC1SMN1; SMN2LMNAMAPT | |
| SCHEMBL12301175 | 0.82 | PTGS2 (0.53) | RAB9ASMN1; SMN2MAPTHTR7MCHR1 | |
| SCHEMBL9770355 | 0.81 | HTR7 (0.48) | RAB9ANPC1SMN1; SMN2LMNAMAPT | |
| SCHEMBL29738631 | 0.81 | HTR7 (0.48) | RAB9ANPC1SMN1; SMN2LMNAMAPT | |
| SCHEMBL5317518 | 0.81 | PTGS2 (0.54) | SMN1; SMN2HTR7PTGS2 | |
| SCHEMBL7264640 | 0.80 | PTGS2 (0.53) | RAB9ANPC1SMN1; SMN2LMNAMAPT | |
| SCHEMBL13162367 | 0.79 | RAB9A (0.42) | RAB9ANPC1SMN1; SMN2MAPTHTR7 | |
| SCHEMBL6438182 | 0.78 | RAB9A (0.44) | RAB9ANPC1SMN1; SMN2LMNAMAPT | |
| SCHEMBL11330397 | 0.78 | RAB9A (0.38) | RAB9ANPC1SMN1; SMN2LMNAMAPT |
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 |
|---|---|---|---|---|---|---|---|
| CN-106432153-B | A kind of sulfur-bearing andrographolidume derivative, its pharmaceutical composition, synthetic method, the application in preparation treatment prostate cancer drug | 四川理工学院 | 2019-02-19 | — | — | CN | disclosed |
| CN-106432153-A | Sulfur-containing andrographolide derivative and pharmaceutical composition and synthesis method thereof and application of sulfur-containing andrographolide derivative in preparation of medicine for treating prostatic cancers | 四川理工学院 | 2017-02-22 | — | — | CN | disclosed |