Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH1 | P35367 | 5/20 | 0.55 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | BRD4 | O60885 | 3/20 | 0.43 |
| ▸ | REN | P00797 | 1/20 | 0.41 |
| ▸ | IKBKB | O14920 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.39 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.39 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.39 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.38 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.38 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.38 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL737976 | 1.00 | HRH1 (0.55) | HRH1CHRM1ALDH1A1NPSR1BRD4 | |
| SCHEMBL740756 | 0.88 | HRH1 (0.52) | HRH1CHRM1BRD4RENMAPT | |
| SCHEMBL740755 | 0.88 | HRH1 (0.52) | HRH1CHRM1BRD4RENMAPT | |
| SCHEMBL742774 | 0.88 | HRH1 (0.54) | HRH1CHRM1BRD4RENMAPT | |
| SCHEMBL742773 | 0.88 | HRH1 (0.54) | HRH1CHRM1BRD4RENMAPT | |
| SCHEMBL739358 | 0.86 | CHRM1 (0.53) | HRH1CHRM1BRD4RENOPRM1 | |
| SCHEMBL739357 | 0.86 | CHRM1 (0.53) | HRH1CHRM1BRD4RENOPRM1 | |
| SCHEMBL739843 | 0.85 | HRH1 (0.70) | HRH1CHRM1BRD4RENKCNH2 | |
| SCHEMBL739842 | 0.85 | HRH1 (0.70) | HRH1CHRM1BRD4RENKCNH2 | |
| SCHEMBL740511 | 0.84 | CHRM1 (0.48) | HRH1CHRM1BRD4REN |
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 |