Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EDNRA | P25101 | 2/20 | 0.50 |
| ▸ | MCL1 | Q07820 | 6/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | MTHFD2 | P13995 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.37 |
| ▸ | TTR | P02766 | 2/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL3612485 | 0.82 | EDNRA (0.66) | EDNRAMCL1KDM4EALDH1A1HPGD | |
| SCHEMBL28136589 | 0.78 | L3MBTL1 (0.50) | MCL1KDM4EHPGDMAPTRAB9A | |
| SCHEMBL28171584 | 0.77 | EDNRA (0.47) | EDNRAMCL1KDM4EHSD17B10NPC1 | |
| SCHEMBL28170922 | 0.77 | MCL1 (0.49) | EDNRAMCL1KDM4EALDH1A1HPGD | |
| SCHEMBL15022380 | 0.77 | EDNRA (0.59) | EDNRAMCL1KDM4EALDH1A1HPGD | |
| SCHEMBL27590200 | 0.76 | EDNRA (0.62) | EDNRAMCL1KDM4EALDH1A1HPGD | |
| SCHEMBL5028068 | 0.73 | EDNRA (0.44) | EDNRAMCL1KDM4EALDH1A1HPGD | |
| SCHEMBL5028041 | 0.73 | MCL1 (0.47) | EDNRAMCL1NPC1MAPTRAB9A | |
| SCHEMBL3879779 | 0.73 | KMT2A (0.52) | MCL1KDM4EALDH1A1HPGDNPC1 | |
| SCHEMBL27804367 | 0.71 | KMT2A (0.45) | EDNRAMCL1KDM4EALDH1A1HPGD |
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-107207488-A | It is used as the bicyclic heteroaryl heteroaryl benzoic acid compounds of retinoic acid receptors β (RAR β) activator | 伦敦皇家学院 | 2017-09-26 | — | — | CN | disclosed |