Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 5/20 | 0.47 |
| ▸ | HRH1 | P35367 | 5/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.47 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.46 |
| ▸ | DPP4 | P27487 | 3/20 | 0.44 |
| ▸ | DPP8 | Q6V1X1 | 2/20 | 0.44 |
| ▸ | UBE2M | P61081 | 1/20 | 0.43 |
| ▸ | DCUN1D1 | Q96GG9 | 1/20 | 0.43 |
| ▸ | PROKR1 | Q8TCW9 | 1/20 | 0.42 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.41 |
| ▸ | PDE2A | O00408 | 2/20 | 0.41 |
| ▸ | CNR2 | P34972 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL740173 | 1.00 | KCNH2 (0.47) | KCNH2HRH1CYP2D6CHRM1DPP4 | |
| SCHEMBL739316 | 0.94 | HRH1 (0.47) | KCNH2HRH1CYP2D6CHRM1DPP4 | |
| SCHEMBL739317 | 0.94 | HRH1 (0.47) | KCNH2HRH1CYP2D6CHRM1DPP4 | |
| SCHEMBL739483 | 0.92 | CNR2 (0.48) | KCNH2HRH1CYP2D6CHRM1DPP4 | |
| SCHEMBL739481 | 0.92 | CNR2 (0.48) | KCNH2HRH1CYP2D6CHRM1DPP4 | |
| SCHEMBL738833 | 0.92 | HRH1 (0.49) | KCNH2HRH1CYP2D6CHRM1DPP4 | |
| SCHEMBL738834 | 0.92 | HRH1 (0.49) | KCNH2HRH1CYP2D6CHRM1DPP4 | |
| SCHEMBL740493 | 0.92 | OPRK1 (0.43) | KCNH2HRH1CYP2D6CHRM1DPP4 | |
| SCHEMBL742023 | 0.92 | DPP4 (0.43) | KCNH2HRH1CYP2D6CHRM1DPP4 | |
| SCHEMBL740538 | 0.92 | HRH1 (0.43) | KCNH2HRH1CYP2D6CHRM1DPP4 |
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 2 patents. 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 | claimed |
| US-8138168-B1 | Renin inhibitors | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2012-03-20 | — | — | US | disclosed |