Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 3/20 | 0.42 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | PDE4A | P27815 | 1/20 | 0.38 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.38 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.38 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.38 |
| ▸ | CACNA2D1 | P54289 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | F10 | P00742 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | AKR1C3 | P42330 | 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 | |
|---|---|---|---|---|
| SCHEMBL5605046 | 0.95 | HPGD (0.46) | HPGDCHRNA7GAAPDE4APDE4B | |
| SCHEMBL8496732 | 0.87 | CHRNA7 (0.42) | HPGDCHRNA7GAAPDE4APDE4B | |
| SCHEMBL28581938 | 0.76 | NR1I2 (0.44) | HPGDCHRNA7GAAPDE4APDE4B | |
| SCHEMBL30300654 | 0.72 | CHRNA7 (0.41) | HPGDCHRNA7ALDH1A1CYP1A2CYP2C19 | |
| SCHEMBL4327657 | 0.72 | CHRNA7 (0.38) | HPGDCHRNA7PDE4APDE4BPDE4C | |
| Hydrochloric Acid SCHEMBL1583186 | 0.71 | SLC6A2 (0.38) | HPGDCHRNA7PDE4APDE4BPDE4C | |
| SCHEMBL3053970 | 0.70 | GAA (0.42) | HPGDGAAALDH1A1MAPTHSD17B10 | |
| SCHEMBL76559 | 0.69 | ALDH1A1 (0.59) | HPGDL3MBTL1ALDH1A1CYP1A2CYP3A4 | |
| Bromide SCHEMBL11452033 | 0.69 | ALDH1A1 (0.36) | HPGDGAAL3MBTL1ALDH1A1MAPT | |
| SCHEMBL14171467 | 0.69 | CACNA2D1 (0.41) | CHRNA7PDE4APDE4BPDE4CPDE4D |
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-2240448-A1 | LACTAM INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 | Vitae Pharmaceuticals, Inc. (US) | 2010-10-20 | — | — | EP | disclosed |
| WO-2009088997-A1 | LACTAM INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 | VITAE PHARMACEUTICALS, INC. (US) | 2009-07-16 | — | — | WO | disclosed |