Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPIA | P62937 | 8/20 | 0.50 |
| ▸ | PTGER1 | P34995 | 9/20 | 0.45 |
| ▸ | PPIF | P30405 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | SGMS2 | Q8NHU3 | 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 | |
|---|---|---|---|---|
| SCHEMBL9126091 | 0.89 | PPIA (0.46) | PPIAPPIFSGMS2 | |
| SCHEMBL9125540 | 0.88 | PPIA (0.50) | PPIAPTGER1PPIF | |
| SCHEMBL9124032 | 0.84 | PPIA (0.53) | PPIAPPIFSGMS2 | |
| SCHEMBL9125346 | 0.83 | PPIA (0.50) | PPIAPPIFSGMS2 | |
| SCHEMBL9127827 | 0.83 | PPIA (0.50) | PPIAPPIFSGMS2 | |
| SCHEMBL9128706 | 0.83 | PPIA (0.52) | PPIAPPIFSGMS2 | |
| SCHEMBL9124958 | 0.83 | PPIA (0.56) | PPIAPPIFSGMS2 | |
| SCHEMBL9127445 | 0.82 | PPIA (0.48) | PPIAPPIFCYP2C19SGMS2 | |
| SCHEMBL9127894 | 0.81 | PPIA (0.55) | PPIAPPIFCYP2C9CYP2C19SGMS2 | |
| SCHEMBL9126123 | 0.81 | PPIA (0.54) | PPIACYP2C19SGMS2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5409943-A | [(alkoxy)pyridinyl]amine compounds which are useful in the treatment of gastrointestinal disorders | SMITHKLINE BEECHAM INTERCREDIT B.V. (NL) | 1995-04-25 | — | — | US | disclosed |
| EP-0625143-A1 | PYRIDINE DERIVATIVES, THEIR PREPARATION AND USE AS MEDICINES | SMITHKLINE BEECHAM INTERCREDIT B.V. (NL) | 1994-11-23 | — | — | EP | disclosed |
| WO-1993015055-A1 | PYRIDINE DERIVATIVES, THEIR PREPARATION AND USE AS MEDICINES | SMITHKLINE BEECHAM INTERCREDIT B.V. (NL) | 1993-08-05 | — | — | WO | disclosed |