Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH1 | P35367 | 8/20 | 0.46 |
| ▸ | KCNH2 | Q12809 | 6/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.46 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.43 |
| ▸ | NLRP3 | Q96P20 | 3/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | PROKR1 | Q8TCW9 | 1/20 | 0.38 |
| ▸ | ITK | Q08881 | 2/20 | 0.37 |
| ▸ | NOS1 | P29475 | 1/20 | 0.37 |
| ▸ | NOS2 | P35228 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL740324 | 0.88 | CYP2C9 (0.44) | HRH1KCNH2CYP2D6CHRM1NLRP3 | |
| SCHEMBL762625 | 0.88 | CYP2C9 (0.44) | HRH1KCNH2CYP2D6CHRM1NLRP3 | |
| SCHEMBL739857 | 0.87 | HRH1 (0.57) | HRH1KCNH2CYP2D6CHRM1USP2 | |
| SCHEMBL739667 | 0.84 | KCNH2 (0.43) | HRH1KCNH2CYP2D6CHRM1TP53 | |
| SCHEMBL739392 | 0.84 | KCNH2 (0.45) | HRH1KCNH2CYP2D6CHRM1TP53 | |
| SCHEMBL740730 | 0.84 | HRH1 (0.44) | HRH1KCNH2CYP2D6CHRM1TP53 | |
| SCHEMBL740966 | 0.83 | KCNH2 (0.44) | HRH1KCNH2CYP2D6CHRM1USP2 | |
| SCHEMBL740684 | 0.82 | HRH1 (0.40) | HRH1KCNH2CYP2D6CHRM1NLRP3 | |
| SCHEMBL740685 | 0.82 | HRH1 (0.40) | HRH1KCNH2CYP2D6CHRM1NLRP3 | |
| SCHEMBL740454 | 0.82 | ADORA2A (0.51) | HRH1KCNH2CYP2D6CHRM1ITK |
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-8138168-B1 | Renin inhibitors | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2012-03-20 | — | — | US | disclosed |