Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.54 |
| ▸ | MAPT | P10636 | 1/20 | 0.54 |
| ▸ | KCNH2 | Q12809 | 10/20 | 0.49 |
| ▸ | SCN3A | Q9NY46 | 4/20 | 0.49 |
| ▸ | S1PR4 | O95977 | 2/20 | 0.46 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.46 |
| ▸ | S1PR5 | Q9H228 | 2/20 | 0.46 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | DPP4 | P27487 | 1/20 | 0.40 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7775270 | 1.00 | KDM4E (0.54) | KDM4EMAPTKCNH2SCN3AS1PR4 | |
| SCHEMBL31370338 | 1.00 | KDM4E (0.54) | KDM4EMAPTKCNH2SCN3AS1PR4 | |
| SCHEMBL135105 | 0.84 | KCNH2 (0.56) | KCNH2SCN3AS1PR4S1PR1S1PR5 | |
| SCHEMBL135106 | 0.84 | KCNH2 (0.56) | KCNH2SCN3AS1PR4S1PR1S1PR5 | |
| SCHEMBL197791 | 0.84 | KCNH2 (0.56) | KCNH2SCN3AS1PR4S1PR1S1PR5 | |
| SCHEMBL5696388 | 0.84 | KCNH2 (0.56) | KCNH2SCN3AS1PR4S1PR1S1PR5 | |
| SCHEMBL1226045 | 0.84 | KCNH2 (0.56) | KCNH2SCN3AS1PR4S1PR1S1PR5 | |
| SCHEMBL197425 | 0.84 | KCNH2 (0.56) | KCNH2SCN3AS1PR4S1PR1S1PR5 | |
| SCHEMBL8513273 | 0.84 | KCNH2 (0.56) | KCNH2SCN3AS1PR4S1PR1S1PR5 | |
| SCHEMBL2831617 | 0.83 | KCNH2 (0.49) | KCNH2SCN3AS1PR4S1PR1S1PR5 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0723974-B1 | Derivatives of mercaptoalkanoyldipeptides, their preparation and pharmaceutical compositions containing them | ADIR (FR) | 2001-08-16 | — | — | EP | disclosed |
| EP-0723974-A1 | Derivatives of mercaptoalkanoyldipeptides, their preparation and pharmaceutical compositions containing them | ADIR ET COMPAGNIE (FR) | 1996-07-31 | — | — | EP | disclosed |