Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 10/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 10/20 | 0.43 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.43 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | RHEB | Q15382 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | TTR | P02766 | 1/20 | 0.32 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | HSPB1 | P04792 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8125202 | 0.85 | ALDH1A1 (0.41) | HTR1ASLC6A2SLC6A4SLC6A3ALDH1A1 | |
| SCHEMBL8123023 | 0.82 | ALDH1A1 (0.39) | HTR1ASLC6A2SLC6A4SLC6A3ALDH1A1 | |
| SCHEMBL8125043 | 0.82 | ALDH1A1 (0.39) | HTR1ASLC6A2SLC6A4SLC6A3ALDH1A1 | |
| SCHEMBL8123025 | 0.81 | KMT2A (0.43) | HTR1ASLC6A2SLC6A4SLC6A3ALDH1A1 | |
| SCHEMBL8125381 | 0.81 | ALDH1A1 (0.38) | HTR1ASLC6A2SLC6A4SLC6A3ALDH1A1 | |
| SCHEMBL8130154 | 0.80 | CASR (0.38) | HTR1ASLC6A2SLC6A4SLC6A3ALDH1A1 | |
| SCHEMBL8122855 | 0.79 | SLC6A2 (0.35) | HTR1ASLC6A2SLC6A4SLC6A3ALDH1A1 | |
| SCHEMBL8115497 | 0.78 | AR (0.38) | HTR1ASLC6A2SLC6A4SLC6A3ALDH1A1 | |
| SCHEMBL8127275 | 0.78 | ALDH1A1 (0.41) | HTR1ASLC6A2SLC6A4SLC6A3ALDH1A1 | |
| SCHEMBL8131299 | 0.78 | SLC6A2 (0.41) | HTR1ASLC6A2SLC6A4SLC6A3ALDH1A1 |
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 |