Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPM4 | Q8TD43 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.34 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.33 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | IDO1 | P14902 | 1/20 | 0.33 |
| ▸ | PPM1A | P35813 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | HPRT1 | P00492 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL28575128 | 0.84 | TRPM4 (0.33) | TRPM4ALDH1A1HSD17B10HIF1ACYP1B1 | |
| SCHEMBL21879676 | 0.84 | HPRT1 (0.42) | ALDH1A1HSD17B10HIF1ACYP1B1CYP1A2 | |
| SCHEMBL14983527 | 0.81 | TRPM4 (0.41) | TRPM4ALDH1A1HSD17B10HIF1ACYP1B1 | |
| SCHEMBL2270952 | 0.80 | ALDH1A1 (0.35) | ALDH1A1HSD17B10CYP1A2MAPTKDM4E | |
| SCHEMBL21879678 | 0.78 | ALDH1A1 (0.40) | ALDH1A1HSD17B10HIF1ACYP1B1CYP1A2 | |
| SCHEMBL14983522 | 0.78 | TRPM4 (0.38) | TRPM4ALDH1A1HSD17B10HIF1ACYP1B1 | |
| SCHEMBL734336 | 0.78 | LPL (0.45) | TRPM4ALDH1A1HSD17B10HIF1ACYP1B1 | |
| SCHEMBL17485941 | 0.75 | CYP11B1 (0.39) | CYP1A2CYP2D6CYP2C19CYP3A4CYP2C9 | |
| SCHEMBL14983531 | 0.75 | TRPM4 (0.45) | TRPM4ALDH1A1HSD17B10HIF1ACYP1B1 | |
| SCHEMBL14261558 | 0.72 | IDO1 (0.45) | ALDH1A1HSD17B10MAPTKDM4EIDO1 |
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-2020085319-A1 | CYCLIC AZINE COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ELECTRON TRANSPORT MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, AND ORGANIC ELECTROLUMINESCENT ELEMENT | 東ソー株式会社 | 2020-04-30 | — | — | WO | disclosed |