Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSTP1 | P09211 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | HCAR2 | Q8TDS4 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL11808157 | 1.00 | GSTP1 (0.35) | GSTP1ATMTSHRNFKB1CYP2C19 | |
| SCHEMBL11810920 | 0.92 | ATM (0.40) | ATMTSHRNFKB1CYP2C19HCAR2 | |
| SCHEMBL11810913 | 0.86 | HCAR2 (0.49) | ATMTSHRNFKB1CYP2C19HCAR2 | |
| SCHEMBL11810926 | 0.86 | HCAR2 (0.49) | ATMTSHRNFKB1CYP2C19HCAR2 | |
| SCHEMBL11743113 | 0.83 | ATM (0.33) | GSTP1ATMHCAR2 | |
| SCHEMBL11743104 | 0.83 | ATM (0.33) | GSTP1ATMHCAR2 | |
| SCHEMBL69841 | 0.83 | TSHR (0.47) | TSHRNFKB1CYP2C19 | |
| SCHEMBL11807662 | 0.80 | TSHR (0.39) | TSHRNFKB1CYP2C19 | |
| SCHEMBL11811701 | 0.78 | ALDH1A1 (0.39) | TSHRNFKB1CYP2C19 | |
| SCHEMBL11806697 | 0.77 | TSHR (0.37) | TSHRNFKB1CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| US-3975357-A | SUBSTITUTED PIPERIDINES | SANKYO COMPANY LIMITED (JA) | 1976-08-17 | — | — | US | disclosed |