Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.44 |
| ▸ | PTPRC | P08575 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.35 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.34 |
| ▸ | HSPA1A | P0DMV8 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL30262411 | 0.84 | ALDH1A1 (0.47) | ALDH1A1HSD17B10PTPRCKDM4EGAA | |
| SCHEMBL2211016 | 0.84 | ALDH1A1 (0.47) | ALDH1A1HSD17B10PTPRCKDM4EGAA | |
| SCHEMBL2212019 | 0.84 | ALDH1A1 (0.47) | ALDH1A1HSD17B10PTPRCKDM4EGAA | |
| SCHEMBL25628805 | 0.83 | HNF4A (0.33) | ALDH1A1HSD17B10KDM4EHPGDNPC1 | |
| SCHEMBL25580683 | 0.82 | PTGS2 (0.33) | ALDH1A1HSD17B10KDM4EHPGDNPC1 | |
| SCHEMBL25580693 | 0.82 | PTGS2 (0.33) | ALDH1A1HSD17B10KDM4EHPGDNPC1 | |
| SCHEMBL25580557 | 0.82 | PTGS2 (0.33) | ALDH1A1HSD17B10KDM4EHPGDNPC1 | |
| SCHEMBL25580564 | 0.82 | PTGS2 (0.33) | ALDH1A1HSD17B10KDM4EHPGDNPC1 | |
| SCHEMBL16684086 | 0.82 | MAPT (0.35) | ALDH1A1HSD17B10KDM4ENPC1RAB9A | |
| SCHEMBL6212117 | 0.81 | ALDH1A1 (0.39) | ALDH1A1HSD17B10KDM4EGAAHPGD |
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 |
|---|---|---|---|---|---|---|---|
| WO-2016097983-A1 | 1-FUNCTIONALIZED DIBENZOFURANS AND DIBENZOTHIOPHENES FOR ORGANIC LIGHT EMITTING DIODES (OLEDS) | IDEMITSU KOSAN CO., LTD. (JP) | 2016-06-23 | — | — | WO | disclosed |