Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.43 |
| ▸ | PDE5A | O76074 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL4717579 | 0.86 | AGTR1 (0.44) | KDM4E | |
| SCHEMBL4721483 | 0.80 | LMNA (0.49) | LMNANPC1PDE4BPDE5ACYP3A4 | |
| SCHEMBL8696774 | 0.78 | NPC1 (0.46) | LMNANPC1PDE4BPDE5AALDH1A1 | |
| SCHEMBL9312267 | 0.78 | KMT2A (0.52) | LMNANPC1PDE4BPDE5ACYP3A4 | |
| SCHEMBL4715208 | 0.77 | AGTR1 (0.45) | — | |
| SCHEMBL1407103 | 0.77 | RAB9A (0.43) | LMNANPC1CYP3A4CYP2C19ALDH1A1 | |
| SCHEMBL4717605 | 0.76 | KDM4E (0.47) | LMNANPC1PDE4BPDE5ACYP3A4 | |
| SCHEMBL20156347 | 0.76 | CYP3A4 (0.42) | LMNANPC1CYP3A4CYP2C19ALDH1A1 | |
| SCHEMBL21272359 | 0.73 | CYP3A4 (0.43) | LMNANPC1CYP3A4CYP2C19ALDH1A1 | |
| SCHEMBL17226642 | 0.72 | NPC1 (0.40) | LMNANPC1PDE4BCYP3A4CYP2C19 |
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-1999114-A2 | PYRAZOLES AS 11-BETA-HSD-1 | F. Hoffmann-la Roche AG (CH) | 2008-12-10 | — | — | EP | disclosed |
| WO-2007107470-A2 | PYRAZOLES AS 11-BETA-HSD-1 | F. HOFFMANN-LA ROCHE AG (CH) | 2007-09-27 | — | — | WO | disclosed |