Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR2 | P34972 | 6/20 | 0.60 |
| ▸ | CNR1 | P21554 | 5/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.56 |
| ▸ | GAA | P10253 | 1/20 | 0.56 |
| ▸ | RAB9A | P51151 | 3/20 | 0.54 |
| ▸ | MEN1 | O00255 | 1/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.53 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.49 |
| ▸ | TYK2 | P29597 | 2/20 | 0.48 |
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | HTT | P42858 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL8299116 | 0.89 | CNR2 (0.48) | CNR2CNR1ALDH1A1KDM4EGAA | |
| Hydrochloric Acid SCHEMBL4185132 | 0.88 | CNR2 (0.47) | CNR2CNR1ALDH1A1KDM4EGAA | |
| SCHEMBL4200640 | 0.84 | CNR2 (0.47) | CNR2CNR1RAB9ATYK2 | |
| SCHEMBL13929052 | 0.84 | CNR2 (0.47) | CNR2CNR1RAB9ATYK2 | |
| SCHEMBL6012159 | 0.79 | ROCK2 (0.49) | RAB9A | |
| SCHEMBL14615139 | 0.79 | GRM4 (0.42) | ALDH1A1 | |
| SCHEMBL6323279 | 0.78 | CNR2 (0.44) | CNR2CNR1ALDH1A1TYK2 | |
| SCHEMBL4200635 | 0.78 | CNR2 (0.44) | CNR2CNR1ALDH1A1TYK2 | |
| SCHEMBL5551331 | 0.77 | CNR2 (0.39) | CNR2CNR1ALDH1A1TYK2LMNA | |
| SCHEMBL13929028 | 0.76 | L3MBTL1 (0.53) | CNR2CNR1ALDH1A1KDM4EMEN1 |
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-1651641-A1 | NICOTINAMIDE DERIVATIVES USEFUL AS PDE4 INHIBITORS | Pfizer Limited (GB) | 2006-05-03 | — | — | EP | disclosed |
| WO-2005009995-A1 | NICOTINAMIDE DERIVATIVES USEFUL AS PDE4 INHIBITORS | PFIZER LIMITED (GB) | 2005-02-03 | — | — | WO | disclosed |