Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 2/20 | 0.38 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | HTR2C | P28335 | 1/20 | 0.34 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9434857 | 0.81 | ALDH1A1 (0.57) | P2RX7SLC9A1ALDH1A1KMT2AMEN1 | |
| SCHEMBL15475206 | 0.80 | MAPK1 (0.55) | ALDH1A1POLBHTTKMT2AMEN1 | |
| SCHEMBL2649520 | 0.80 | SMN1; SMN2 (0.41) | P2RX7SLC9A1ALDH1A1POLBHTT | |
| SCHEMBL6671874 | 0.74 | NPSR1 (0.34) | P2RX7ALDH1A1POLBHTTKMT2A | |
| SCHEMBL9433998 | 0.74 | ALDH1A1 (0.31) | P2RX7ALDH1A1TSHR | |
| SCHEMBL1154434 | 0.74 | ALDH1A1 (0.62) | P2RX7ALDH1A1POLBHTTKMT2A | |
| SCHEMBL6071045 | 0.71 | ALDH1A1 (0.49) | P2RX7ALDH1A1POLBHTTKMT2A | |
| SCHEMBL9603257 | 0.71 | ALDH1A1 (0.58) | P2RX7ALDH1A1POLBHTTKMT2A | |
| SCHEMBL8322443 | 0.71 | KCNN4 (0.31) | — | |
| SCHEMBL10759212 | 0.71 | NPSR1 (0.31) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0934940-A1 | CYTOKINE PRODUCTION INHIBITORS, TRIAZEPINE COMPOUNDS, AND INTERMEDIATES THEREOF | Japan Tobacco Inc. (JP) | 1999-08-11 | — | — | EP | disclosed |