Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | TSPO | P30536 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | HRH1 | P35367 | 1/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.37 |
| ▸ | JAK2 | O60674 | 1/20 | 0.37 |
| ▸ | JAK3 | P52333 | 1/20 | 0.37 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.37 |
| ▸ | ABL1 | P00519 | 1/20 | 0.36 |
| ▸ | EGFR | P00533 | 1/20 | 0.36 |
| ▸ | SRC | P12931 | 1/20 | 0.36 |
| ▸ | ABL2 | P42684 | 1/20 | 0.36 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL5233817 | 0.91 | CYP2D6 (0.38) | ALDH1A1CYP2D6HRH1KCNH2MAPT | |
| SCHEMBL5231037 | 0.90 | GRIN2B (0.38) | TSPOCYP2D6HRH1KCNH2OPRK1 | |
| SCHEMBL2996782 | 0.89 | ALDH1A1 (0.39) | ALDH1A1HTTHIF1ATSPOCYP2D6 | |
| SCHEMBL5227499 | 0.89 | TSPO (0.34) | TSPOCYP2D6HRH1KCNH2EGFR | |
| SCHEMBL5229499 | 0.89 | CYP2D6 (0.34) | CYP2D6HRH1KCNH2MAPT | |
| SCHEMBL5232300 | 0.85 | CYP2D6 (0.33) | TSPOCYP2D6HRH1KCNH2MAPT | |
| SCHEMBL5231299 | 0.84 | CYP2D6 (0.33) | CYP2D6HRH1KCNH2MAPT | |
| SCHEMBL5231760 | 0.84 | SCN9A (0.37) | CYP2D6HRH1KCNH2MAPT | |
| SCHEMBL5229100 | 0.84 | PDE5A (0.39) | CYP2D6HRH1KCNH2 | |
| SCHEMBL5233042 | 0.83 | CYP2D6 (0.39) | ALDH1A1CYP2D6HRH1KCNH2 |
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-1664059-B1 | THIENOPYRROLES AS ANTIVIRAL AGENTS | ANGELETTI P IST RICHERCHE BIO (IT) | 2007-09-12 | — | — | EP | claimed |