Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DPP4 | P27487 | 7/20 | 0.45 |
| ▸ | HRH1 | P35367 | 7/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 8/20 | 0.43 |
| ▸ | CHRM1 | P11229 | 3/20 | 0.42 |
| ▸ | DPP8 | Q6V1X1 | 5/20 | 0.42 |
| ▸ | DPP9 | Q86TI2 | 5/20 | 0.42 |
| ▸ | DPP7 | Q9UHL4 | 5/20 | 0.42 |
| ▸ | 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 | |
|---|---|---|---|---|
| SCHEMBL738234 | 1.00 | DPP4 (0.45) | DPP4HRH1CYP2D6TP53MAPT | |
| SCHEMBL738944 | 0.92 | HRH1 (0.45) | HRH1CYP2D6KCNH2CHRM1CYP3A4 | |
| SCHEMBL738945 | 0.92 | HRH1 (0.45) | HRH1CYP2D6KCNH2CHRM1CYP3A4 | |
| SCHEMBL739071 | 0.92 | HRH1 (0.47) | DPP4HRH1CYP2D6TP53MAPT | |
| SCHEMBL738770 | 0.92 | HRH1 (0.47) | DPP4HRH1CYP2D6TP53MAPT | |
| SCHEMBL739563 | 0.92 | HRH1 (0.47) | DPP4HRH1CYP2D6TP53MAPT | |
| SCHEMBL738771 | 0.92 | HRH1 (0.47) | DPP4HRH1CYP2D6TP53MAPT | |
| SCHEMBL741067 | 0.92 | HRH1 (0.47) | DPP4HRH1CYP2D6TP53MAPT | |
| SCHEMBL740690 | 0.92 | HRH1 (0.47) | DPP4HRH1CYP2D6TP53MAPT | |
| SCHEMBL742028 | 0.92 | HRH1 (0.47) | DPP4HRH1CYP2D6TP53MAPT |
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 |