Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSB | P07858 | 1/20 | 0.37 |
| ▸ | CTSS | P25774 | 1/20 | 0.37 |
| ▸ | CTSK | P43235 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 9/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 7/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.35 |
| ▸ | HRH1 | P35367 | 2/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | AGTR1 | P30556 | 2/20 | 0.34 |
| ▸ | AGTR2 | P50052 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | CHRM1 | P11229 | 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 | |
|---|---|---|---|---|
| SCHEMBL762785 | 0.91 | HRH1 (0.42) | CTSBCTSSCTSKKCNH2HRH1 | |
| SCHEMBL762990 | 0.87 | KCNH2 (0.39) | MAPTTP53KCNH2HRH1CYP2D6 | |
| SCHEMBL740435 | 0.86 | KCNH2 (0.38) | MAPTTP53KCNH2HRH1CYP2D6 | |
| SCHEMBL740434 | 0.86 | KCNH2 (0.38) | MAPTTP53KCNH2HRH1CYP2D6 | |
| SCHEMBL10292140 | 0.84 | PADI4 (0.37) | CTSBCTSSCTSKTP53KCNH2 | |
| SCHEMBL762577 | 0.84 | CTSB (0.36) | CTSBCTSSCTSKKCNH2HRH1 | |
| SCHEMBL762559 | 0.84 | KCNH2 (0.39) | CTSBCTSSCTSKMAPTALDH1A1 | |
| SCHEMBL762648 | 0.84 | HRH1 (0.36) | CTSBCTSSCTSKKCNH2HRH1 | |
| SCHEMBL741060 | 0.84 | HRH1 (0.38) | MAPTALDH1A1TP53KCNH2HRH1 | |
| SCHEMBL762585 | 0.84 | PPARA (0.36) | CTSBCTSSCTSKKCNH2HRH1 |
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 |