Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 1/20 | 0.35 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.34 |
| ▸ | AR | P10275 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 5/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | ESR1 | P03372 | 2/20 | 0.32 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.31 |
| ▸ | TP53 | P04637 | 2/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 2/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL15965473 | 1.00 | HTR1A (0.35) | HTR1APDK2ARMAPTL3MBTL1 | |
| SCHEMBL15965471 | 0.97 | PDK2 (0.35) | HTR1APDK2ARMAPTL3MBTL1 | |
| SCHEMBL15965470 | 0.89 | HTR1A (0.36) | HTR1AARMAPTL3MBTL1TDP1 | |
| SCHEMBL15965469 | 0.89 | HTR1A (0.36) | HTR1AARMAPTL3MBTL1TDP1 | |
| SCHEMBL15965468 | 0.85 | L3MBTL1 (0.35) | HTR1APDK2ARMAPTL3MBTL1 | |
| SCHEMBL15966204 | 0.81 | PTPN11 (0.40) | PDK2MAPK1HTTALDH1A1KDM4E | |
| SCHEMBL15965480 | 0.81 | AR (0.37) | HTR1AARMAPTL3MBTL1TDP1 | |
| SCHEMBL15965465 | 0.81 | AR (0.37) | HTR1AARMAPTL3MBTL1TDP1 | |
| SCHEMBL15966205 | 0.81 | PDK2 (0.34) | PDK2MAPTSMN1; SMN2TP53HTT | |
| SCHEMBL29317741 | 0.78 | ESR1 (0.52) | ARMAPTL3MBTL1ESR1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| US-9520569-B2 | Aryl compounds for application in a highly polar solvent | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2016-12-13 | — | — | US | disclosed |
| US-20140231717-A1 | COMPOUND | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2014-08-21 | — | — | US | disclosed |