Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MPO | P05164 | 1/20 | 0.51 |
| ▸ | PPARG | P37231 | 1/20 | 0.47 |
| ▸ | BRD4 | O60885 | 1/20 | 0.47 |
| ▸ | MTNR1B | P49286 | 5/20 | 0.46 |
| ▸ | NQO2 | P16083 | 4/20 | 0.46 |
| ▸ | MTNR1A | P48039 | 4/20 | 0.46 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.44 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.40 |
| ▸ | MAOA | P21397 | 1/20 | 0.40 |
| ▸ | MAOB | P27338 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9482430 | 0.91 | MPO (0.64) | MPOPPARGBRD4MTNR1BNQO2 | |
| SCHEMBL10078298 | 0.86 | MPO (0.52) | MPOMTNR1BNQO2MTNR1ASIGMAR1 | |
| SCHEMBL27366916 | 0.84 | MAPT (0.42) | BRD4L3MBTL1KMT2ASMN1; SMN2ALDH1A1 | |
| SCHEMBL24821194 | 0.84 | KDM4C (0.45) | PPARGBRD4KMT2AMAOBCYP1A2 | |
| SCHEMBL7403188 | 0.82 | KDM4E (0.47) | MPOPPARGBRD4L3MBTL1SMN1; SMN2 | |
| SCHEMBL10078296 | 0.82 | MPO (0.51) | MPOMTNR1BNQO2MTNR1ASIGMAR1 | |
| SCHEMBL13937830 | 0.80 | MPO (0.77) | MPOMTNR1BNQO2MTNR1ASIGMAR1 | |
| SCHEMBL991381 | 0.79 | PPARG (0.50) | PPARGBRD4MTNR1BNQO2MTNR1A | |
| SCHEMBL12930796 | 0.79 | MPO (0.45) | MPOPPARGBRD4MTNR1BNQO2 | |
| SCHEMBL11058265 | 0.77 | PPARG (0.51) | MPOPPARGBRD4MTNR1BNQO2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012070025-A1 | PROCESS FOR THE PREPARATION OF AGOMELATINE | CADILA PHARMACEUTICALS LTD (IN) | 2012-05-31 | — | — | WO | claimed |
| WO-2012070025-A1 | PROCESS FOR THE PREPARATION OF AGOMELATINE | CADILA PHARMACEUTICALS LTD (IN) | 2012-05-31 | — | — | WO | disclosed |
| WO-2012070025-A1 | PROCESS FOR THE PREPARATION OF AGOMELATINE | CADILA PHARMACEUTICALS LTD (IN) | 2012-05-31 | — | — | WO | disclosed |