Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 8/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 7/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.40 |
| ▸ | MEN1 | O00255 | 4/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.40 |
| ▸ | CLK4 | Q9HAZ1 | 4/20 | 0.40 |
| ▸ | LMNA | P02545 | 4/20 | 0.40 |
| ▸ | TSHR | P16473 | 3/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.40 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.38 |
| ▸ | ABCG2 | Q9UNQ0 | 6/20 | 0.37 |
| ▸ | TP53 | P04637 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.34 |
| ▸ | GABRG2 | P18507 | 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 | |
|---|---|---|---|---|
| SCHEMBL21782522 | 1.00 | CYP1A2 (0.40) | CYP1A2CYP3A4ALDH1A1CYP2D6MEN1 | |
| SCHEMBL21782502 | 0.98 | PTGER4 (0.39) | CYP1A2CYP3A4ALDH1A1CYP2D6MEN1 | |
| SCHEMBL21782438 | 0.97 | PTGER4 (0.38) | CYP1A2CYP3A4ALDH1A1CYP2D6MEN1 | |
| SCHEMBL21782506 | 0.97 | PTGER4 (0.38) | CYP1A2CYP3A4ALDH1A1CYP2D6MEN1 | |
| SCHEMBL21782442 | 0.95 | PTGER4 (0.38) | CYP1A2CYP3A4ALDH1A1CYP2D6MEN1 | |
| SCHEMBL21782504 | 0.95 | PTGER4 (0.38) | CYP1A2CYP3A4ALDH1A1CYP2D6MEN1 | |
| SCHEMBL24271664 | 0.95 | PTGER4 (0.36) | CYP1A2CYP3A4ALDH1A1CYP2D6MEN1 | |
| SCHEMBL21782447 | 0.94 | PTGER4 (0.38) | CYP1A2CYP3A4ALDH1A1CYP2D6MEN1 | |
| SCHEMBL21782441 | 0.94 | PTGER4 (0.38) | CYP1A2CYP3A4ALDH1A1CYP2D6MEN1 | |
| SCHEMBL21782503 | 0.94 | PTGER4 (0.39) | CYP1A2CYP3A4ALDH1A1CYP2D6MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3617290-B1 | ORGANIC MOLECULES FOR OPTOELECTRONIC DEVICES | CYNORA GMBH (DE) | 2022-03-09 | — | — | EP | disclosed |
| EP-3617290-A1 | ORGANIC MOLECULES FOR OPTOELECTRONIC DEVICES | CYNORA GMBH (DE) | 2020-03-04 | — | — | EP | disclosed |