Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PLA2G1B | P04054 | 1/20 | 0.52 |
| ▸ | POLB | P06746 | 1/20 | 0.52 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | PNMT | P11086 | 1/20 | 0.43 |
| ▸ | S1PR3 | Q99500 | 2/20 | 0.43 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.43 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.43 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.43 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 5/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 5/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 5/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL6894820 | 0.85 | CYP1A2 (0.60) | POLBCYP2D6CYP1A2CYP2C19MEN1 | |
| SCHEMBL6892337 | 0.85 | LMNA (0.52) | CYP2D6CYP1A2CYP2C19PNMTMEN1 | |
| SCHEMBL3649450 | 0.84 | TACR1 (0.46) | POLBCYP2D6CYP1A2CYP2C19MEN1 | |
| SCHEMBL6895745 | 0.83 | LMNA (0.47) | POLBCYP2D6CYP1A2CYP2C19SIGMAR1 | |
| SCHEMBL6894577 | 0.83 | SMN1; SMN2 (0.40) | CYP2D6CYP1A2CYP2C19MEN1KMT2A | |
| SCHEMBL6895808 | 0.81 | SMN1; SMN2 (0.57) | CYP2D6CYP1A2CYP2C19SIGMAR1MEN1 | |
| SCHEMBL6890978 | 0.80 | LMNA (0.50) | CYP2D6CYP1A2CYP2C19MEN1KMT2A | |
| SCHEMBL3641583 | 0.79 | CYP1A2 (0.41) | POLBCYP2D6CYP1A2CYP2C19MEN1 | |
| SCHEMBL6892044 | 0.79 | LMNA (0.38) | CYP2D6CYP1A2CYP2C19MEN1KMT2A | |
| Hydrochloric Acid SCHEMBL7112448 | 0.79 | MEN1 (0.43) | CYP2D6CYP1A2CYP2C19MEN1KMT2A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-2004502669-A | — | — | 2004-01-29 | — | — | JP | claimed |
| EP-1353898-A2 | COMPOUNDS TO TREAT ALZHEIMER'S DISEASE | Elan Pharmaceuticals, Inc. (US) | 2003-10-22 | — | — | EP | claimed |
| WO-2002002512-A2 | COMPOUNDS TO TREAT ALZHEIMER'S DISEASE | ELAN PHARMACEUTICALS, INC. (US) | 2002-01-10 | — | — | WO | claimed |