Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.36 |
| ▸ | HRH1 | P35367 | 3/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.35 |
| ▸ | MEN1 | O00255 | 3/20 | 0.35 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.35 |
| ▸ | TACR2 | P21452 | 1/20 | 0.34 |
| ▸ | DRD2 | P14416 | 2/20 | 0.34 |
| ▸ | DRD3 | P35462 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
| ▸ | USP2 | O75604 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL10293032 | 0.92 | PADI4 (0.37) | TACR1KCNH2HRH1CYP2D6KMT2A | |
| SCHEMBL738775 | 0.90 | CFD (0.38) | KCNH2HRH1CYP2D6ALDH1A1TSHR | |
| SCHEMBL738776 | 0.90 | CFD (0.38) | KCNH2HRH1CYP2D6ALDH1A1TSHR | |
| SCHEMBL739901 | 0.90 | HRH1 (0.46) | KCNH2HRH1CYP2D6CHRM1USP2 | |
| SCHEMBL739252 | 0.87 | KCNH2 (0.41) | KCNH2HRH1CYP2D6ALDH1A1TSHR | |
| SCHEMBL742275 | 0.86 | HRH1 (0.42) | TACR1KCNH2HRH1CYP2D6CHRM1 | |
| SCHEMBL739598 | 0.86 | HRH1 (0.35) | KCNH2HRH1CYP2D6ALDH1A1TSHR | |
| SCHEMBL740708 | 0.86 | HRH1 (0.39) | TACR1KCNH2HRH1CYP2D6ALDH1A1 | |
| SCHEMBL10293031 | 0.86 | PADI4 (0.38) | KCNH2HRH1CYP2D6ALDH1A1TSHR | |
| SCHEMBL740857 | 0.85 | KCNH2 (0.39) | KCNH2HRH1CYP2D6CHRM1TP53 |
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 |