Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.53 |
| ▸ | HPGD | P15428 | 2/20 | 0.53 |
| ▸ | EIF2AK4 | Q9P2K8 | 1/20 | 0.51 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 3/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | RET | P07949 | 5/20 | 0.46 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.46 |
| ▸ | ADAM10 | O14672 | 1/20 | 0.46 |
| ▸ | MMP1 | P03956 | 1/20 | 0.46 |
| ▸ | MMP2 | P08253 | 1/20 | 0.46 |
| ▸ | MMP3 | P08254 | 1/20 | 0.46 |
| ▸ | MMP7 | P09237 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL30898339 | 0.92 | SMN1; SMN2 (0.55) | SMN1; SMN2HPGDEIF2AK4KDM4EPOLB | |
| SCHEMBL30408906 | 0.92 | SMN1; SMN2 (0.55) | SMN1; SMN2HPGDEIF2AK4KDM4EPOLB | |
| SCHEMBL30328491 | 0.89 | SMN1; SMN2 (0.60) | SMN1; SMN2HPGDKDM4EPOLBMAPT | |
| SCHEMBL30329931 | 0.85 | SMN1; SMN2 (0.44) | SMN1; SMN2HPGDEIF2AK4CYP11B2KDM4E | |
| SCHEMBL17038781 | 0.83 | SMN1; SMN2 (0.74) | SMN1; SMN2HPGDKDM4EPOLBMAPT | |
| SCHEMBL29564805 | 0.83 | SMN1; SMN2 (0.74) | SMN1; SMN2HPGDKDM4EPOLBMAPT | |
| SCHEMBL30328437 | 0.82 | SMN1; SMN2 (0.47) | SMN1; SMN2HPGDEIF2AK4CYP11B2KDM4E | |
| SCHEMBL484867 | 0.81 | CYP11B2 (0.54) | SMN1; SMN2EIF2AK4CYP11B2MAPTCYP1A2 | |
| SCHEMBL30328115 | 0.81 | CYP11B2 (0.51) | SMN1; SMN2EIF2AK4CYP11B2MAPTALDH1A1 | |
| SCHEMBL30328058 | 0.80 | EIF2AK4 (0.53) | SMN1; SMN2HPGDEIF2AK4CYP11B2ALDH1A1 |
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-4415706-A1 | SMALL MOLECULE MODULATORS OF GLUCOCEREBROSIDASE ACTIVITY AND USES THEREOF | Vanqua Bio, Inc. (US) | 2024-08-21 | — | — | EP | disclosed |
| WO-2023064343-A1 | SMALL MOLECULE MODULATORS OF GLUCOCEREBROSIDASE ACTIVITY AND USES THEREOF | VANQUA BIO, INC. (US) | 2023-04-20 | — | — | WO | disclosed |