Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 5/20 | 0.60 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.60 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.60 |
| ▸ | MAPK10 | P53779 | 2/20 | 0.57 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.52 |
| ▸ | LMNA | P02545 | 2/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.52 |
| ▸ | HPGD | P15428 | 1/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.52 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.49 |
| ▸ | HTR7 | P34969 | 1/20 | 0.49 |
| ▸ | GSK3B | P49841 | 2/20 | 0.48 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.48 |
| ▸ | CDK1 | P06493 | 1/20 | 0.48 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.48 |
| ▸ | GSK3A | P49840 | 1/20 | 0.48 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL12486939 | 0.84 | MAPK10 (0.61) | CYP1A2CYP3A4ALDH1A1CYP2D6MAPK10 | |
| SCHEMBL11919644 | 0.79 | WNT3A (0.54) | CYP1A2CYP3A4ALDH1A1CYP2D6MAPK10 | |
| SCHEMBL17376184 | 0.79 | ACVR2A (0.49) | CYP1A2CYP3A4ALDH1A1CYP2D6MAPK10 | |
| SCHEMBL12487325 | 0.78 | MAPK10 (0.54) | CYP1A2CYP3A4ALDH1A1CYP2D6MAPK10 | |
| SCHEMBL16135445 | 0.78 | MAPK10 (0.54) | CYP1A2CYP3A4ALDH1A1CYP2D6MAPK10 | |
| SCHEMBL12268828 | 0.78 | RORB (0.56) | CYP1A2CYP3A4ALDH1A1CYP2D6MAPK10 | |
| SCHEMBL3361169 | 0.78 | DYRK1A (0.60) | CYP1A2CYP3A4CYP2D6MAPK10CYP2C19 | |
| SCHEMBL17376313 | 0.78 | PDGFRB (0.48) | CYP1A2CYP3A4ALDH1A1CYP2D6MAPK10 | |
| SCHEMBL12486954 | 0.78 | ALOX5AP (0.49) | CYP1A2CYP3A4ALDH1A1CYP2D6MAPK10 | |
| SCHEMBL15163993 | 0.77 | FDPS (0.65) | MAPK10GSK3BMAPK14ADORA3PTPRC |
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-2005080390-A1 | IMIDAZOPYRIDINE DERIVATIVES AS BSR-3 ANTAGONISTS | BIOFOCUS DISCOVERY LTD (GB) | 2005-09-01 | — | — | WO | disclosed |