Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 10/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.38 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.38 |
| ▸ | PRKACA | P17612 | 1/20 | 0.38 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.38 |
| ▸ | PAK1 | Q13153 | 1/20 | 0.38 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.38 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.38 |
| ▸ | PRKD2 | Q9BZL6 | 1/20 | 0.38 |
| ▸ | NR1H3 | Q13133 | 2/20 | 0.37 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.37 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.37 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.37 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.37 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28106960 | 0.89 | NR1H2 (0.39) | NR1H2MEN1KMT2AROCK2CHEK2 | |
| SCHEMBL4389624 | 0.84 | AKR1C3 (0.49) | NR1H2MEN1KMT2ANR1H3AKR1C3 | |
| SCHEMBL13191270 | 0.83 | NR1H2 (0.43) | NR1H2NR1H3GABRG2GABRB3GABRA5 | |
| SCHEMBL17226217 | 0.82 | NR1H2 (0.47) | NR1H2AKR1C3AKR1C2ALDH1A1HPGD | |
| SCHEMBL7913537 | 0.81 | NR1H2 (0.56) | NR1H2NR1H3CA12CA9 | |
| SCHEMBL19013549 | 0.81 | NR1H2 (0.41) | NR1H2MEN1KMT2AROCK2CHEK2 | |
| SCHEMBL29955454 | 0.81 | NR1H2 (0.39) | NR1H2MEN1KMT2AROCK2CHEK2 | |
| SCHEMBL29631993 | 0.81 | NR1H2 (0.41) | NR1H2MEN1KMT2AROCK2CHEK2 | |
| SCHEMBL18990363 | 0.81 | NR1H2 (0.40) | NR1H2MEN1KMT2AROCK2CHEK2 | |
| SCHEMBL2930214 | 0.81 | NR1H2 (0.39) | NR1H2MEN1KMT2AROCK2CHEK2 |
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-2017075694-A1 | ANTIBIOTIC COMPOUNDS, PHARMACEUTICAL FORMULATIONS THEREOF AND METHODS AND USES THEREFOR | SIMON FRASER UNIVERSITY (CA) | 2017-05-11 | — | — | WO | disclosed |