Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 1/20 | 0.51 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.47 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.47 |
| ▸ | HTR1A | P08908 | 1/20 | 0.47 |
| ▸ | SCN1A | P35498 | 1/20 | 0.47 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.47 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.47 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | ADRB2 | P07550 | 2/20 | 0.45 |
| ▸ | ADRB1 | P08588 | 2/20 | 0.45 |
| ▸ | ADRB3 | P13945 | 2/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL720047 | 0.84 | MAPK1 (0.49) | MAPK1HIF1ATDP1CYP2D6SLC6A3 | |
| Benzoic Acid SCHEMBL722545 | 0.77 | DAO (0.41) | MAPK1CYP2D6ALDH1A1CYP1A2CYP2C19 | |
| Benzoic Acid SCHEMBL720048 | 0.77 | DAO (0.41) | MAPK1CYP2D6ALDH1A1CYP1A2CYP2C19 | |
| SCHEMBL235921 | 0.75 | MAPK1 (0.81) | MAPK1HIF1ATDP1CYP2D6SLC6A3 | |
| SCHEMBL27456900 | 0.75 | ALDH1A1 (0.72) | MAPK1HIF1ATDP1SLC6A3ALDH1A1 | |
| SCHEMBL17583004 | 0.75 | MAPK1 (0.48) | MAPK1HIF1ATDP1CYP2D6SLC6A3 | |
| SCHEMBL9947121 | 0.74 | MAPK1 (0.79) | MAPK1HIF1ATDP1CYP2D6SLC6A3 | |
| SCHEMBL570777 | 0.74 | MAPK1 (0.67) | MAPK1HIF1ATDP1CYP2D6SLC6A3 | |
| SCHEMBL1786754 | 0.74 | MAPK1 (0.79) | MAPK1HIF1ATDP1CYP2D6SLC6A3 | |
| SCHEMBL13706534 | 0.74 | MAPK1 (0.57) | MAPK1HIF1ATDP1CYP2D6SLC6A3 |
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-8481235-B2 | Pentanediol ester containing photoconductors | XEROX CORPORATION (US) | 2013-07-09 | — | — | US | disclosed |
| US-20120052428-A1 | PENTANEDIOL ESTER CONTAINING PHOTOCONDUCTORS | XEROX CORPORATION (US) | 2012-03-01 | — | — | US | disclosed |