Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.54 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.54 |
| ▸ | UTS2R | Q9UKP6 | 1/20 | 0.47 |
| ▸ | EGFR | P00533 | 5/20 | 0.44 |
| ▸ | MEN1 | O00255 | 3/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | CSF1R | P07333 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | NOS2 | P35228 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | CDK2 | P24941 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | CDK1 | P06493 | 1/20 | 0.40 |
| ▸ | PSMB1 | P20618 | 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 | |
|---|---|---|---|---|
| SCHEMBL2475800 | 0.89 | CYP1A2 (0.55) | CYP1A2CYP3A4CYP2C19CYP2C9UTS2R | |
| SCHEMBL2473155 | 0.84 | CYP1A2 (0.70) | CYP1A2CYP3A4CYP2C19CYP2C9UTS2R | |
| Hydrochloric Acid SCHEMBL1738610 | 0.83 | CYP1A2 (0.68) | CYP1A2CYP3A4CYP2C19CYP2C9UTS2R | |
| SCHEMBL2475860 | 0.81 | CYP1A2 (0.49) | CYP1A2CYP3A4CYP2C19CYP2C9UTS2R | |
| SCHEMBL2470230 | 0.79 | CYP1A2 (0.50) | CYP1A2CYP3A4CYP2C19CYP2C9UTS2R | |
| SCHEMBL12198919 | 0.78 | EGFR (0.46) | CYP1A2CYP3A4CYP2C19CYP2C9EGFR | |
| SCHEMBL22132916 | 0.78 | EGFR (0.46) | CYP1A2CYP3A4CYP2C19CYP2C9EGFR | |
| SCHEMBL2473550 | 0.70 | CYP3A4 (1.00) | CYP1A2CYP3A4CYP2C19CYP2C9EGFR | |
| SCHEMBL2474287 | 0.69 | CYP3A4 (0.74) | CYP1A2CYP3A4CYP2C19CYP2C9EGFR | |
| SCHEMBL2475050 | 0.68 | EGFR (0.60) | CYP1A2CYP3A4CYP2C19CYP2C9UTS2R |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1787991-B2 | PYRROLO[2,3-c]PYRIDINE COMPOUND, PROCESS FOR PRODUCING THE SAME, AND USE | TAKEDA PHARMACEUTICALS CO (JP) | 2020-06-24 | — | — | EP | disclosed |
| EP-1787991-B1 | PYRROLO[2,3-c]PYRIDINE COMPOUND, PROCESS FOR PRODUCING THE SAME, AND USE | TAKEDA PHARMACEUTICAL (JP) | 2011-10-05 | — | — | EP | disclosed |