Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 1/20 | 0.43 |
| ▸ | MAOB | P27338 | 1/20 | 0.43 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.42 |
| ▸ | EGLN2 | Q96KS0 | 6/20 | 0.42 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.41 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.41 |
| ▸ | HRH2 | P25021 | 1/20 | 0.41 |
| ▸ | HRH1 | P35367 | 1/20 | 0.41 |
| ▸ | CYP11B2 | P19099 | 6/20 | 0.41 |
| ▸ | CYP11B1 | P15538 | 5/20 | 0.41 |
| ▸ | KDM1A | O60341 | 1/20 | 0.38 |
| ▸ | AHR | P35869 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL17630042 | 0.89 | MAOB (0.43) | MAOAMAOBS1PR1CYP11B2CYP11B1 | |
| SCHEMBL7634772 | 0.89 | ALDH1A1 (0.48) | S1PR1EGLN2PDE3BPDE3AHRH2 | |
| SCHEMBL27806613 | 0.87 | KIF11 (0.47) | S1PR1EGLN2PDE3BPDE3AHRH2 | |
| SCHEMBL23625527 | 0.85 | ALDH1A1 (0.56) | S1PR1EGLN2PDE3BPDE3AHRH2 | |
| SCHEMBL12496569 | 0.82 | PTGS1 (0.49) | S1PR1EGLN2PDE3BPDE3AHRH2 | |
| SCHEMBL2786090 | 0.82 | MMP3 (0.57) | MAOAEGLN2HRH2HRH1CYP11B2 | |
| SCHEMBL2572264 | 0.81 | ESR2 (0.53) | EGLN2CYP11B2CYP11B1 | |
| SCHEMBL2154193 | 0.80 | CYP11B2 (0.53) | EGLN2PDE3BPDE3ACYP11B2CYP11B1 | |
| SCHEMBL25767772 | 0.80 | CYP11B1 (0.45) | S1PR1EGLN2PDE3BPDE3AHRH2 | |
| SCHEMBL7229011 | 0.79 | HRH2 (0.47) | MAOAMAOBHRH2HRH1CYP11B2 |
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-2016046782-A1 | IMIDAZOLE BIARYL COMPOUNDS AS S-NITROSOGLUTATHIONE REDUCTASE INHIBITORS | GLENMARK PHARMACEUTICALS S.A. (CH) | 2016-03-31 | — | — | WO | disclosed |