Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MYC | P01106 | 1/20 | 0.39 |
| ▸ | ALDH1A3 | P47895 | 2/20 | 0.38 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.38 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.38 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.38 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.38 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.38 |
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.36 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.34 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.34 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.33 |
| ▸ | JAK2 | O60674 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL22562605 | 0.97 | MYC (0.41) | MYCALDH1A3GABRA1GABRG2GABRB3 | |
| SCHEMBL22562591 | 0.94 | MYC (0.39) | MYCALDH1A3GABRA1GABRG2GABRB3 | |
| SCHEMBL22562205 | 0.93 | ALDH1A3 (0.38) | MYCALDH1A3GABRA1GABRG2GABRB3 | |
| SCHEMBL22562516 | 0.93 | CLK4 (0.39) | MYCALDH1A3GABRA1GABRG2GABRB3 | |
| SCHEMBL22562294 | 0.93 | CYP11B1 (0.38) | ALDH1A3GABRG2GABRB3GABRA5GABRA3 | |
| SCHEMBL22562556 | 0.92 | MYC (0.40) | MYCALDH1A3GABRA1GABRG2GABRB3 | |
| SCHEMBL22562603 | 0.91 | ALDH1A3 (0.46) | ALDH1A3GABRA1GABRG2GABRB3GABRA5 | |
| SCHEMBL22562256 | 0.91 | MYC (0.41) | MYCALDH1A3GABRA1GABRG2GABRB3 | |
| SCHEMBL22562207 | 0.90 | ALDH1A3 (0.40) | MYCALDH1A3GABRA1GABRG2GABRB3 | |
| SCHEMBL22562517 | 0.89 | CSNK2A1 (0.40) | MYCALDH1A3GABRA1GABRG2GABRB3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3418278-B1 | ORGANIC MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC DEVICES | CYNORA GMBH (DE) | 2020-10-21 | — | — | EP | disclosed |