Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.36 |
| ▸ | APP | P05067 | 3/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.31 |
| ▸ | CHEK1 | O14757 | 2/20 | 0.31 |
| ▸ | WEE1 | P30291 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.30 |
| ▸ | BRAF | P15056 | 1/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | USP2 | O75604 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL11714272 | 0.82 | ALDH1A1 (0.54) | ALDH1A1HPGDHSD17B10BCL2L1APP | |
| SCHEMBL21411499 | 0.81 | ALDH1A1 (0.36) | ALDH1A1HPGDHSD17B10BCL2L1APP | |
| SCHEMBL1378148 | 0.76 | PDE10A (0.44) | ALDH1A1HPGDHSD17B10APPCYP3A4 | |
| SCHEMBL5705096 | 0.73 | CASP1 (0.41) | ALDH1A1HPGDHSD17B10CYP3A4CYP2C9 | |
| SCHEMBL31408924 | 0.69 | CYP1A2 (0.36) | ALDH1A1CYP1A2CYP3A4CYP2D6CYP19A1 | |
| SCHEMBL20704975 | 0.68 | ESR1 (0.55) | ALDH1A1HPGDHSD17B10BCL2L1CYP1A2 | |
| SCHEMBL23102601 | 0.67 | IDO1 (0.44) | APPCYP1A2CYP3A4CYP2D6CYP19A1 | |
| SCHEMBL3128375 | 0.64 | CYP3A4 (0.65) | ALDH1A1HPGDHSD17B10APPCYP1A2 | |
| SCHEMBL26259958 | 0.63 | IDO1 (0.39) | ALDH1A1HSD17B10CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL26259972 | 0.63 | IDO1 (0.39) | CYP1A2CYP3A4CYP2D6CYP19A1CYP2C9 |
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-3057940-A1 | PHENYL-DIHYDROPYRIDINE DERIVATIVES AS INHIBITORS OF ALDOSTERONE SYNTHASE | F.HOFFMANN-LA ROCHE AG (CH) | 2016-08-24 | — | — | EP | disclosed |
| WO-2015055602-A1 | PHENYL-DIHYDROPYRIDINE DERIVATIVES AS INHIBITORS OF ALDOSTERONE SYNTHASE | F. HOFFMANN-LA ROCHE AG (CH) | 2015-04-23 | — | — | WO | disclosed |