Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 17/20 | 0.56 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.43 |
| ▸ | CNR2 | P34972 | 1/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.43 |
| ▸ | NAMPT | P43490 | 1/20 | 0.41 |
| ▸ | MMP2 | P08253 | 1/20 | 0.41 |
| ▸ | MMP13 | P45452 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL18390889 | 0.90 | HRH3 (0.63) | HRH3CYP2D6CNR2KCNH2MMP2 | |
| SCHEMBL25629007 | 0.86 | HRH3 (0.51) | HRH3CYP2D6KCNH2MMP2MMP13 | |
| SCHEMBL21584689 | 0.81 | HTT (0.54) | HRH3CNR2NAMPT | |
| SCHEMBL25629645 | 0.81 | HTT (0.54) | HRH3CNR2NAMPT | |
| SCHEMBL104632 | 0.81 | HRH3 (0.63) | HRH3CYP2D6KCNH2 | |
| SCHEMBL22874736 | 0.81 | EPHX2 (0.42) | HRH3CNR2NAMPT | |
| SCHEMBL22875072 | 0.81 | EPHX2 (0.42) | HRH3CNR2NAMPT | |
| SCHEMBL25628747 | 0.81 | EPHX2 (0.42) | HRH3CNR2NAMPT | |
| SCHEMBL13013114 | 0.79 | HPGD (0.57) | HRH3CNR2NAMPT | |
| SCHEMBL14453913 | 0.79 | HRH3 (0.66) | HRH3CYP2D6KCNH2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023098825-A1 | SOS1 INHIBITOR, PHARMACEUTICAL COMPOSITION COMPRISING SAME, AND USE THEREOF | 勤浩医药（苏州）有限公司 | 2023-06-08 | — | — | WO | disclosed |