Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 4/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | USP2 | O75604 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.32 |
| ▸ | CRHBP | P24387 | 2/20 | 0.30 |
| ▸ | CRHR2 | Q13324 | 2/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.30 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL4705497 | 0.80 | LMNA (0.40) | LMNA | |
| SCHEMBL9051047 | 0.73 | CYP1A2 (0.44) | LMNACYP1A2CYP2C9MEN1USP2 | |
| SCHEMBL1702299 | 0.63 | HIF1A (0.37) | LMNACYP1A2CYP2C9MEN1USP2 | |
| Toluene SCHEMBL10532790 | 0.63 | LMNA (0.44) | LMNACYP1A2CYP2C9MEN1USP2 | |
| SCHEMBL6767976 | 0.62 | CHRNB2 (0.37) | MEN1USP2ALDH1A1PLA2G1BMAPT | |
| SCHEMBL8201697 | 0.61 | CYP3A4 (0.46) | LMNACYP1A2CYP2C9MEN1USP2 | |
| SCHEMBL2290692 | 0.61 | CYP1A2 (0.50) | LMNACYP1A2CYP2C9MEN1USP2 | |
| SCHEMBL6649783 | 0.61 | ALDH1A1 (0.39) | LMNAMEN1ALDH1A1MAPTKMT2A | |
| SCHEMBL900908 | 0.60 | MAPT (0.33) | CYP1A2CYP2C9MEN1MAPTKMT2A | |
| Hydrochloric Acid SCHEMBL9751203 | 0.59 | CYP3A4 (0.43) | CYP1A2CYP2C9MEN1USP2ALDH1A1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2009001203-A2 | AN IMPROVED PROCESS FOR THE PREPARATION OF APREPITANT | ORCHID CHEMICALS & PHARMACEUTICALS LIMITED (IN) | 2008-12-31 | — | — | WO | disclosed |