Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | ACE | P12821 | 6/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | APEX1 | P27695 | 1/20 | 0.37 |
| ▸ | DPP4 | P27487 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.35 |
| ▸ | POLB | P06746 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | USP2 | O75604 | 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 | |
|---|---|---|---|---|
| SCHEMBL11280204 | 1.00 | MAPK1 (0.39) | MAPK1CYP1A2SMN1; SMN2ACETDP1 | |
| SCHEMBL11255094 | 0.98 | ACE (0.39) | MAPK1CYP1A2SMN1; SMN2ACETDP1 | |
| SCHEMBL7350466 | 0.98 | ACE (0.39) | MAPK1CYP1A2SMN1; SMN2ACETDP1 | |
| Hydrochloric Acid SCHEMBL11261206 | 0.97 | ACE (0.38) | MAPK1CYP1A2SMN1; SMN2ACETDP1 | |
| SCHEMBL6560268 | 0.87 | TDP1 (0.46) | MAPK1CYP1A2SMN1; SMN2ACETDP1 | |
| SCHEMBL6560275 | 0.87 | TDP1 (0.46) | MAPK1CYP1A2SMN1; SMN2ACETDP1 | |
| SCHEMBL6560272 | 0.87 | TDP1 (0.46) | MAPK1CYP1A2SMN1; SMN2ACETDP1 | |
| SCHEMBL10893075 | 0.84 | ACE (0.54) | ACETDP1MAPTTSHRCYP3A4 | |
| SCHEMBL7340790 | 0.84 | ACE (0.54) | ACETDP1MAPTTSHRCYP3A4 | |
| SCHEMBL7340784 | 0.84 | ACE (0.54) | ACETDP1MAPTTSHRCYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0046292-A1 | Substituted caprylolactam derivatives as antihypertensives, process for preparing and pharmaceutical composition comprising them | MERCK & CO. INC. (US) | 1982-02-24 | — | — | EP | disclosed |