Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.39 |
| ▸ | HTR3B | O95264 | 1/20 | 0.39 |
| ▸ | HTR3A | P46098 | 1/20 | 0.39 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.39 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | SLC22A12 | Q96S37 | 3/20 | 0.35 |
| ▸ | AR | P10275 | 4/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | RAPGEF3 | O95398 | 2/20 | 0.33 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.32 |
| ▸ | NOTUM | Q6P988 | 2/20 | 0.32 |
| ▸ | PLA2G7 | Q13093 | 1/20 | 0.32 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CCR2 | P41597 | 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 | |
|---|---|---|---|---|
| SCHEMBL8593598 | 0.81 | MAPK1 (0.47) | HTR3EHTR3BHTR3AHTR3DHTR3C | |
| SCHEMBL58303 | 0.77 | MAPK1 (0.61) | HTR3EHTR3BHTR3AHTR3DHTR3C | |
| SCHEMBL29397209 | 0.77 | MAPK1 (0.61) | HTR3EHTR3BHTR3AHTR3DHTR3C | |
| SCHEMBL10712015 | 0.76 | VCAM1 (0.42) | MAPK1TDP1SLC22A12MAPTTRPA1 | |
| SCHEMBL1190703 | 0.72 | AR (0.49) | AR | |
| SCHEMBL24902229 | 0.71 | CYP3A4 (0.52) | MAPK1TDP1TRPA1CYP3A4 | |
| SCHEMBL17027595 | 0.70 | CYP3A4 (0.36) | TDP1SLC22A12ARTRPA1CYP3A4 | |
| SCHEMBL3104369 | 0.70 | CYP3A4 (0.50) | HTR3EHTR3BHTR3AHTR3DHTR3C | |
| SCHEMBL28227373 | 0.69 | AR (0.47) | AR | |
| SCHEMBL162277 | 0.69 | RAB9A (0.40) | MAPK1TDP1SLC22A12ARMAPT |
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-106232666-A | Post-modification polycarbodiimide | 巴斯夫欧洲公司 | 2016-12-14 | — | — | CN | disclosed |