Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | NR1H2 | P55055 | 2/20 | 0.35 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | FAAH | O00519 | 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 | |
|---|---|---|---|---|
| SCHEMBL5359872 | 0.88 | CYP3A4 (0.38) | CYP3A4CYP2C19CYP1A2MAPTKMT2A | |
| SCHEMBL5357482 | 0.84 | CYP3A4 (0.40) | CYP3A4CYP2C19CYP1A2MAPTKMT2A | |
| SCHEMBL14347734 | 0.77 | POLB (0.33) | CYP3A4CYP2C19CYP1A2KMT2AGAA | |
| SCHEMBL7703560 | 0.76 | MPO (0.47) | CYP1A2MAPTKMT2AGAATP53 | |
| SCHEMBL5356947 | 0.73 | ELANE (0.44) | CYP1A2MAPTKMT2AGAATP53 | |
| SCHEMBL1234271 | 0.72 | MAPT (0.42) | CYP1A2MAPTKMT2AGAATP53 | |
| SCHEMBL5362674 | 0.72 | ADORA3 (0.40) | CYP3A4CYP2C19CYP1A2MAPTKMT2A | |
| SCHEMBL1234207 | 0.71 | MAPT (0.45) | CYP1A2MAPTKMT2AGAATP53 | |
| SCHEMBL10436902 | 0.70 | LMNA (0.43) | CYP1A2MAPTKMT2AGAAADORA3 | |
| SCHEMBL731191 | 0.70 | CNR1 (0.43) | CYP1A2MAPTKMT2AGAATP53 |
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-2007145349-A2 | SUBSTITUTED PYRROLE DERIVATIVES | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2007-12-21 | — | — | WO | disclosed |