Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 5/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | ATR | Q13535 | 2/20 | 0.37 |
| ▸ | MTOR | P42345 | 5/20 | 0.37 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.37 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.36 |
| ▸ | BRD4 | O60885 | 3/20 | 0.36 |
| ▸ | BRD2 | P25440 | 2/20 | 0.35 |
| ▸ | BRD3 | Q15059 | 2/20 | 0.35 |
| ▸ | EHMT2 | Q96KQ7 | 1/20 | 0.35 |
| ▸ | EHMT1 | Q9H9B1 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL4788321 | 0.82 | ALDH1A1 (0.37) | MAPTKDM4EMTORPIK3CABRD4 | |
| SCHEMBL4787688 | 0.81 | BRD4 (0.53) | CYP2C9CYP1A2CYP2C19CYP3A4MAPT | |
| SCHEMBL6025161 | 0.65 | SLC6A2 (0.39) | — | |
| SCHEMBL4748170 | 0.62 | CA2 (0.46) | MAPTKDM4EMTORPIK3CACA2 | |
| SCHEMBL7900089 | 0.62 | CA2 (0.46) | MAPTMTORPIK3CABRD4BRD2 | |
| SCHEMBL7892625 | 0.62 | BRD4 (0.49) | MAPTKDM4EMEN1KMT2AMTOR | |
| SCHEMBL4788324 | 0.62 | BRD4 (0.49) | MAPTKDM4EMTORBRD4BRD2 | |
| SCHEMBL1271555 | 0.62 | MTOR (0.64) | CYP2C9CYP1A2CYP2C19MAPTKDM4E | |
| SCHEMBL1270925 | 0.61 | MTOR (0.67) | CYP2C9CYP3A4ATRMTORPIK3CA | |
| SCHEMBL1271916 | 0.59 | MTOR (0.60) | CYP2C9CYP1A2CYP2C19KDM4EMEN1 |
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-2008110891-A2 | NEW HETEROCYCLIC COMPOUNDS | ORCHID RESEARCH LABORATORIES LIMITED, (IN) | 2008-09-18 | — | — | WO | claimed |