Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | TTR | P02766 | 1/20 | 0.34 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | RHEB | Q15382 | 1/20 | 0.33 |
| ▸ | PTPN11 | Q06124 | 2/20 | 0.33 |
| ▸ | MAPK3 | P27361 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | IDO1 | P14902 | 1/20 | 0.32 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.32 |
| ▸ | DPP4 | P27487 | 1/20 | 0.30 |
| ▸ | HTR1A | P08908 | 1/20 | 0.30 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8124891 | 0.84 | NPSR1 (0.43) | ALDH1A1NPSR1KDM4EHPGDATM | |
| SCHEMBL8115363 | 0.81 | ALDH1A1 (0.37) | ALDH1A1NPSR1KDM4EHPGDATM | |
| SCHEMBL8129366 | 0.79 | ALDH1A1 (0.42) | ALDH1A1NPSR1KDM4EHPGDATM | |
| SCHEMBL8140427 | 0.79 | NPSR1 (0.36) | ALDH1A1NPSR1KDM4EHPGDATM | |
| SCHEMBL8125892 | 0.77 | DPP4 (0.39) | ALDH1A1NPSR1KDM4EHPGDATM | |
| SCHEMBL8141745 | 0.73 | ALDH1A1 (0.35) | ALDH1A1NPSR1KMT2AMEN1TTR | |
| SCHEMBL2751884 | 0.70 | ALDH1A1 (0.42) | ALDH1A1NPSR1KDM4EHPGDATM | |
| SCHEMBL8131243 | 0.67 | ALDH1A1 (0.42) | ALDH1A1NPSR1KDM4EHPGDATM | |
| SCHEMBL7171371 | 0.67 | HPGD (0.42) | ALDH1A1NPSR1HPGDATMKMT2A | |
| SCHEMBL8124193 | 0.66 | RHEB (0.46) | ALDH1A1NPSR1KDM4EHPGDATM |
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-1028945-A1 | SUBSTITUTED PYRIDINE COMPOUNDS AS ANTI-INFLAMMATORY AGENTS | Amgen Inc. (US) | 2000-08-23 | — | — | EP | disclosed |
| WO-1999024404-A1 | SUBSTITUTED PYRIDINE COMPOUNDS AS ANTI-INFLAMMATORY AGENTS | AMGEN INC. (US) | 1999-05-20 | — | — | WO | disclosed |