Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 8/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.35 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL10519903 | 1.00 | SIGMAR1 (0.47) | SIGMAR1CYP2C9CYP3A4RECQLMAPT | |
| SCHEMBL13007694 | 0.74 | SIGMAR1 (0.61) | SIGMAR1NPSR1KDM4EALDH1A1TSHR | |
| SCHEMBL435250 | 0.73 | SIGMAR1 (0.59) | SIGMAR1MAPTNPSR1KDM4EALDH1A1 | |
| SCHEMBL27431595 | 0.73 | SIGMAR1 (0.59) | SIGMAR1NPSR1KDM4EALDH1A1TSHR | |
| SCHEMBL1614544 | 0.72 | SIGMAR1 (0.67) | SIGMAR1SLC6A2SLC6A4 | |
| SCHEMBL29666490 | 0.72 | SIGMAR1 (0.67) | SIGMAR1SLC6A2SLC6A4 | |
| SCHEMBL10519909 | 0.70 | KMT2A (0.52) | CYP2C9CYP3A4MAPTMEN1KMT2A | |
| SCHEMBL24865037 | 0.70 | SIGMAR1 (0.54) | SIGMAR1MAPTKDM4EALDH1A1TSHR | |
| SCHEMBL30804570 | 0.70 | SIGMAR1 (0.54) | SIGMAR1MAPTKDM4EALDH1A1TSHR | |
| SCHEMBL28654785 | 0.69 | RECQL (0.62) | CYP2C9CYP3A4RECQLALDH1A1TSHR |
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-4863904-A | Dipeptides as renin inhibitors | KISSEI PHARMACEUTICAL CO., LTD. (JP) | 1989-09-05 | — | — | US | disclosed |
| EP-0181110-A2 | Histidine derivatives as renin inhibitors | Kissei Pharmaceutical Co. Ltd. (JP) | 1986-05-14 | — | — | EP | disclosed |