Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPIA | P62937 | 10/20 | 0.50 |
| ▸ | PPIF | P30405 | 1/20 | 0.47 |
| ▸ | SGMS2 | Q8NHU3 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.38 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.38 |
| ▸ | EPHA2 | P29317 | 1/20 | 0.38 |
| ▸ | KDR | P35968 | 1/20 | 0.38 |
| ▸ | CNR1 | P21554 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9126039 | 0.89 | PPIA (0.52) | PPIAPPIFSGMS2RAB9AAKR1C3 | |
| SCHEMBL9125551 | 0.84 | PPIA (0.53) | PPIAPPIFSGMS2RAB9A | |
| SCHEMBL9124032 | 0.84 | PPIA (0.53) | PPIAPPIFSGMS2RAB9AAKR1C3 | |
| SCHEMBL9357595 | 0.82 | PPIF (0.46) | PPIAPPIFSGMS2ERBB2EPHA2 | |
| SCHEMBL9124294 | 0.79 | PPIA (0.50) | PPIAPPIFSGMS2RAB9ACNR1 | |
| SCHEMBL9127827 | 0.79 | PPIA (0.50) | PPIAPPIFSGMS2RAB9ACNR1 | |
| SCHEMBL9124036 | 0.78 | PPIF (0.48) | PPIAPPIFSGMS2 | |
| SCHEMBL9126812 | 0.77 | PPIA (0.52) | PPIAPPIFRAB9ANPC1 | |
| SCHEMBL9128706 | 0.77 | PPIA (0.52) | PPIAPPIFSGMS2RAB9AAKR1C3 | |
| SCHEMBL9126643 | 0.76 | PPIF (0.44) | PPIAPPIFSGMS2ERBB2EPHA2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0625143-A1 | PYRIDINE DERIVATIVES, THEIR PREPARATION AND USE AS MEDICINES | SMITHKLINE BEECHAM INTERCREDIT B.V. (NL) | 1994-11-23 | — | — | EP | claimed |
| WO-1993015055-A1 | PYRIDINE DERIVATIVES, THEIR PREPARATION AND USE AS MEDICINES | SMITHKLINE BEECHAM INTERCREDIT B.V. (NL) | 1993-08-05 | — | — | WO | claimed |
| 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 |