Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 1/20 | 0.42 |
| ▸ | CTSK | P43235 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | SCN9A | Q15858 | 6/20 | 0.40 |
| ▸ | SCN10A | Q9Y5Y9 | 2/20 | 0.40 |
| ▸ | ANO1 | Q5XXA6 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.36 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.36 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | GLA | P06280 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.34 |
| ▸ | FEN1 | P39748 | 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 | |
|---|---|---|---|---|
| SCHEMBL4632696 | 0.91 | CTSS (0.44) | CTSSCTSKLMNASCN9ASCN10A | |
| SCHEMBL4600646 | 0.91 | SCN9A (0.41) | CTSSCTSKLMNASCN9ASCN10A | |
| SCHEMBL4632372 | 0.90 | SCN9A (0.35) | CTSSCTSKLMNASCN9ASCN10A | |
| SCHEMBL4602360 | 0.90 | ANO1 (0.41) | SCN9AANO1SMN1; SMN2 | |
| SCHEMBL4600968 | 0.88 | ALOX5AP (0.37) | SCN9AANO1SMN1; SMN2MEN1KMT2A | |
| SCHEMBL4598878 | 0.81 | CTSS (0.43) | CTSSCTSKSCN9ASCN10AANO1 | |
| SCHEMBL4600120 | 0.81 | CTSS (0.48) | CTSSCTSKLMNASCN9ASCN10A | |
| SCHEMBL4598164 | 0.80 | CTSS (0.42) | CTSSCTSKSCN9AANO1NPC1 | |
| SCHEMBL4602131 | 0.80 | KCNA5 (0.40) | LMNASMN1; SMN2RAB9AKCNA5TSHR | |
| SCHEMBL4598249 | 0.80 | CTSS (0.42) | CTSSCTSKLMNASCN9AANO1 |
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-1912946-A1 | PYRIDINE DERIVATIVES AS DIPEPTEDYL PEPTIDASE INHIBITORS | Eli Lilly and Company (US) | 2008-04-23 | — | — | EP | disclosed |
| WO-2007015767-A1 | PYRIDINE DERIVATIVES AS DIPEPTEDYL PEPTIDASE INHIBITORS | ELI LILLY AND COMPANY (US) | 2007-02-08 | — | — | WO | disclosed |