Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE3B | Q13370 | 3/20 | 0.39 |
| ▸ | PDE3A | Q14432 | 3/20 | 0.39 |
| ▸ | P2RY12 | Q9H244 | 3/20 | 0.39 |
| ▸ | APP | P05067 | 4/20 | 0.38 |
| ▸ | YWHAG | P61981 | 1/20 | 0.38 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.37 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | F2 | P00734 | 1/20 | 0.35 |
| ▸ | GLA | P06280 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | AKR1B10 | O60218 | 2/20 | 0.35 |
| ▸ | AKR1B1 | P15121 | 2/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | MAOB | P27338 | 1/20 | 0.34 |
| ▸ | TYR | P14679 | 1/20 | 0.33 |
| ▸ | MET | P08581 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL25399532 | 0.82 | PDE3B (0.38) | PDE3BPDE3AP2RY12APPMTNR1A | |
| SCHEMBL25396335 | 0.76 | SMN1; SMN2 (0.50) | ALDH1A1F2KDM4ESMN1; SMN2MAOB | |
| SCHEMBL20809627 | 0.74 | TP53 (0.47) | MTNR1AMTNR1BALDH1A1HTT | |
| SCHEMBL25399578 | 0.74 | GAA (0.53) | ALDH1A1HPGDAKR1B1KDM4E | |
| SCHEMBL31733937 | 0.73 | ESR1 (0.47) | ALDH1A1HPGDKDM4ESMN1; SMN2 | |
| SCHEMBL30306725 | 0.71 | APP (0.68) | APPYWHAGALDH1A1HPGDAKR1B1 | |
| SCHEMBL5613913 | 0.71 | APP (0.68) | APPYWHAGALDH1A1HPGDAKR1B1 | |
| SCHEMBL8031627 | 0.70 | LDHA (0.50) | ALDH1A1GLAKDM4ESMN1; SMN2 | |
| SCHEMBL18995952 | 0.70 | MAP4K4 (0.43) | ALDH1A1HPGDKDM4E | |
| SCHEMBL15922937 | 0.69 | NPC1 (0.60) | ALDH1A1HPGDHTTKDM4ESMN1; SMN2 |
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-2023169554-A1 | METHIONINE ADENOSINE TRANSFERASE INHIBITOR, PREPARATION METHOD THEREFOR AND USE THEREOF | 赛诺哈勃药业（成都）有限公司 | 2023-09-14 | — | — | WO | disclosed |