Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.51 |
| ▸ | RAB9A | P51151 | 1/20 | 0.51 |
| ▸ | PPIA | P62937 | 9/20 | 0.50 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.41 |
| ▸ | PPIF | P30405 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | C5AR1 | P21730 | 1/20 | 0.40 |
| ▸ | CRHBP | P24387 | 1/20 | 0.40 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL9122341 | 0.91 | PPIA (0.51) | PPIASIGMAR1PPIFC5AR1 | |
| SCHEMBL9128504 | 0.90 | NPC1 (0.54) | NPC1RAB9APPIAC5AR1 | |
| SCHEMBL9125077 | 0.89 | PPIA (0.62) | PPIAPPIFC5AR1 | |
| SCHEMBL9125087 | 0.89 | PPIA (0.59) | NPC1RAB9APPIAMAPTKMT2A | |
| SCHEMBL9126099 | 0.86 | PPIF (0.41) | NPC1RAB9APPIAMAPTKDM4E | |
| SCHEMBL9127905 | 0.82 | PPIA (0.45) | PPIASIGMAR1PPIFALDH1A1 | |
| SCHEMBL9126127 | 0.81 | PPIA (0.45) | RAB9APPIAMAPTSIGMAR1PPIF | |
| SCHEMBL2783284 | 0.81 | PPIA (0.58) | PPIAPPIF | |
| SCHEMBL9124960 | 0.81 | PPIA (0.47) | PPIAMAPTKDM4EGAASIGMAR1 | |
| SCHEMBL9125102 | 0.80 | PPIA (0.42) | RAB9APPIAMAPTSIGMAR1PPIF |
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 |