Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 2/20 | 0.44 |
| ▸ | MAOA | P21397 | 1/20 | 0.43 |
| ▸ | RORC | P51449 | 11/20 | 0.42 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL6505415 | 0.86 | NPC1 (0.45) | MAOBMAOAL3MBTL1CYP1A2CYP3A4 | |
| SCHEMBL6532325 | 0.83 | NOTUM (0.47) | MAOBMAOASIGMAR1L3MBTL1NOTUM | |
| SCHEMBL6532336 | 0.82 | NOTUM (0.47) | MAOBMAOASIGMAR1KMT2ANOTUM | |
| SCHEMBL6926066 | 0.80 | RXRA (0.41) | MAOBMAOAL3MBTL1NOTUM | |
| SCHEMBL6528013 | 0.80 | NOTUM (0.46) | MAOBMAOASIGMAR1L3MBTL1CYP1A2 | |
| SCHEMBL5624788 | 0.79 | NPC1 (0.41) | MAOBMAOAL3MBTL1LMNAMAPT | |
| SCHEMBL6923533 | 0.77 | KDM1A (0.41) | MAOBMAOACYP1A2CYP3A4CYP2D6 | |
| SCHEMBL6529890 | 0.75 | NOTUM (0.38) | MAOBMAOANOTUM | |
| SCHEMBL6528811 | 0.75 | DRD2 (0.35) | MAOBMAOANOTUM | |
| SCHEMBL6527848 | 0.73 | MAPT (0.36) | KMT2ANOTUMMEN1LMNAMAPT |
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-2005082892-A2 | TRIAZOLE COMPOUNDS AS ANTIBACTERIAL AGENTS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | DR. REDDY'S LABORATORIES LTD. (IN) | 2005-09-09 | — | — | WO | disclosed |