Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK7 | P50613 | 2/20 | 0.41 |
| ▸ | CDK1 | P06493 | 1/20 | 0.41 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.41 |
| ▸ | CDK2 | P24941 | 1/20 | 0.41 |
| ▸ | CCNH | P51946 | 1/20 | 0.41 |
| ▸ | MNAT1 | P51948 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | GBA1 | P04062 | 2/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 4/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL7408899 | 1.00 | CDK7 (0.41) | CDK7CDK1CCNE1CDK2CCNH | |
| SCHEMBL6376835 | 1.00 | CDK7 (0.41) | CDK7CDK1CCNE1CDK2CCNH | |
| SCHEMBL6380856 | 1.00 | CDK7 (0.41) | CDK7CDK1CCNE1CDK2CCNH | |
| SCHEMBL7208859 | 1.00 | CDK7 (0.41) | CDK7CDK1CCNE1CDK2CCNH | |
| SCHEMBL6382124 | 1.00 | CDK7 (0.41) | CDK7CDK1CCNE1CDK2CCNH | |
| SCHEMBL27514756 | 0.81 | MAOA (0.40) | MAOAMAOBGBA1SLC6A2SLC6A4 | |
| SCHEMBL613290 | 0.73 | OPRL1 (0.51) | MAOAMAOBGBA1SLC6A2SLC6A4 | |
| SCHEMBL7213533 | 0.73 | CDK1 (0.35) | CDK7CDK1CCNE1CDK2CCNH | |
| SCHEMBL7209171 | 0.73 | CDK1 (0.35) | CDK7CDK1CCNE1CDK2CCNH | |
| SCHEMBL11426560 | 0.72 | OPRM1 (0.46) | OPRL1OPRM1TACR1 |
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-1278730-A2 | 4-BENZYL-1- 2-(4-HYDROXY-PHENOXY)-ETHYL]-PIPERIDINE-3,4-DIOL | F. HOFFMANN-LA ROCHE AG (CH) | 2003-01-29 | — | — | EP | disclosed |
| WO-2001081309-A2 | 4-BENZYL-1-[2-(4-HYDROXY-PHENOXY)-ETHYL]-PIPERIDINE-3,4-DIOL | F. HOFFMANN-LA ROCHE AG (CH) | 2001-11-01 | — | — | WO | disclosed |