Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 2/20 | 0.34 |
| ▸ | CACNA1B | Q00975 | 2/20 | 0.33 |
| ▸ | HRH2 | P25021 | 1/20 | 0.33 |
| ▸ | HRH1 | P35367 | 1/20 | 0.33 |
| ▸ | KLK5 | Q9Y337 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | MMP1 | P03956 | 1/20 | 0.32 |
| ▸ | MMP9 | P14780 | 1/20 | 0.32 |
| ▸ | MMP13 | P45452 | 1/20 | 0.32 |
| ▸ | CNR2 | P34972 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7899697 | 0.91 | PROKR1 (0.39) | CACNA1BHRH2HRH1KLK5ALDH1A1 | |
| SCHEMBL7905913 | 0.85 | CACNA1B (0.35) | CACNA1BHRH2HRH1KLK5ALDH1A1 | |
| SCHEMBL7891211 | 0.84 | PROKR1 (0.42) | HRH2HRH1KLK5ALDH1A1CNR2 | |
| SCHEMBL2788383 | 0.84 | KLK5 (0.36) | CACNA1BHRH2HRH1KLK5CNR2 | |
| SCHEMBL7902566 | 0.83 | PROKR1 (0.38) | HRH2HRH1KLK5CNR2 | |
| SCHEMBL2789222 | 0.82 | PROKR1 (0.41) | ALDH1A1LMNACNR2 | |
| SCHEMBL2814433 | 0.82 | PROKR1 (0.39) | HRH2HRH1KLK5ALDH1A1CNR2 | |
| SCHEMBL2814434 | 0.82 | PROKR1 (0.39) | HRH2HRH1KLK5ALDH1A1CNR2 | |
| SCHEMBL7896929 | 0.82 | CACNA1B (0.33) | CACNA1BHRH2HRH1KLK5ALDH1A1 | |
| SCHEMBL7906019 | 0.81 | PDE2A (0.34) | CACNA1BHRH2HRH1KLK5ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010111634-A2 | RENIN INHIBITORS | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2010-09-30 | — | — | WO | disclosed |