Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.41 |
| ▸ | PIK3CB | P42338 | 2/20 | 0.41 |
| ▸ | PIK3CG | P48736 | 2/20 | 0.41 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 4/20 | 0.38 |
| ▸ | RAB9A | P51151 | 4/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | STAT1 | P42224 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | DYRK1A | Q13627 | 4/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL25372929 | 0.86 | L3MBTL1 (0.42) | ALDH1A1HPGDPIK3CAPIK3CBPIK3CG | |
| SCHEMBL1845956 | 0.85 | PIK3CA (0.45) | ALDH1A1HPGDPIK3CAPIK3CBPIK3CG | |
| SCHEMBL29063447 | 0.78 | KDM4E (0.47) | ALDH1A1HPGDSMN1; SMN2CYP1A2CYP2C9 | |
| SCHEMBL3088370 | 0.75 | MEN1 (0.39) | ALDH1A1HPGDPIK3CAPIK3CBPIK3CG | |
| SCHEMBL1450929 | 0.73 | PIK3CA (0.47) | ALDH1A1HPGDPIK3CAPIK3CBPIK3CG | |
| SCHEMBL3083725 | 0.70 | POLB (0.38) | ALDH1A1HPGDNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL1841799 | 0.70 | L3MBTL1 (0.46) | ALDH1A1HPGDPIK3CAPIK3CBPIK3CG | |
| SCHEMBL3094290 | 0.69 | SMN1; SMN2 (0.36) | ALDH1A1HPGDNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL2952498 | 0.69 | CA1 (0.42) | PI4KBNPSR1 | |
| SCHEMBL19565681 | 0.68 | NPSR1 (0.41) | ALDH1A1HPGDNPC1RAB9ASMN1; 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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116693467-B | Thiazole amine MBL inhibitor and preparation method and application thereof | 四川大学 | 2025-02-14 | — | — | CN | disclosed |
| CN-116693467-A | Thiazole amine MBL inhibitor and preparation method and application thereof | 四川大学 | 2023-09-05 | — | — | CN | disclosed |
| WO-2023160582-A1 | THIAZOLAMINE MBL INHIBITOR, AND PREPARATION METHOD THEREFOR AND USE THEREOF | 四川大学 | 2023-08-31 | — | — | WO | disclosed |