Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.56 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.56 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.55 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.54 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.54 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.54 |
| ▸ | CASP1 | P29466 | 1/20 | 0.54 |
| ▸ | CASP7 | P55210 | 1/20 | 0.54 |
| ▸ | HBB | P68871 | 1/20 | 0.54 |
| ▸ | AKR1B1 | P15121 | 2/20 | 0.51 |
| ▸ | PLAU | P00749 | 1/20 | 0.50 |
| ▸ | HPRT1 | P00492 | 2/20 | 0.47 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.46 |
| ▸ | PRKDC | P78527 | 1/20 | 0.46 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.46 |
| ▸ | MITF | O75030 | 1/20 | 0.45 |
| ▸ | ITGB2 | P05107 | 1/20 | 0.42 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.42 |
| ▸ | ITGAL | P20701 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL11417516 | 0.90 | ALDH1A1 (0.52) | ALDH1A1HSD17B10CYP3A4MAPK14HIF1A | |
| SCHEMBL1527441 | 0.87 | ALDH1A1 (0.65) | ALDH1A1HSD17B10CYP3A4HIF1ATDP1 | |
| SCHEMBL6426697 | 0.85 | HPRT1 (0.64) | ALDH1A1HSD17B10CYP3A4HIF1ATDP1 | |
| SCHEMBL6138724 | 0.85 | HPRT1 (0.64) | ALDH1A1HSD17B10CYP3A4HIF1ATDP1 | |
| SCHEMBL20407332 | 0.82 | ALDH1A1 (0.58) | ALDH1A1HSD17B10CYP3A4HIF1ATDP1 | |
| SCHEMBL4221729 | 0.81 | MAPK14 (0.69) | ALDH1A1HSD17B10CYP3A4MAPK14TDP1 | |
| SCHEMBL29391827 | 0.80 | ALDH1A1 (0.65) | ALDH1A1HSD17B10CYP3A4MAPK14HIF1A | |
| SCHEMBL30186719 | 0.80 | ALDH1A1 (0.65) | ALDH1A1HSD17B10CYP3A4MAPK14HIF1A | |
| SCHEMBL268735 | 0.80 | ALDH1A1 (0.65) | ALDH1A1HSD17B10CYP3A4MAPK14HIF1A | |
| SCHEMBL4181934 | 0.77 | ALDH1A1 (0.58) | ALDH1A1HSD17B10CYP3A4MAPK14HIF1A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2017095086-A1 | ORGANIC LIGHT-EMITTING COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME | 주식회사 두산 | 2017-06-08 | — | — | WO | disclosed |
| EP-0798288-B1 | TRICICLIC COMPOUNDS | KYOWA HAKKO KOGYO KK (JP) | 2001-05-16 | — | — | EP | disclosed |
| EP-0798288-A1 | TRICICLIC COMPOUNDS | KYOWA HAKKO KOGYO CO., LTD. (JP) | 1997-10-01 | — | — | EP | disclosed |