Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PHGDH | O43175 | 6/20 | 0.32 |
| ▸ | BRD4 | O60885 | 2/20 | 0.31 |
| ▸ | MAPT | P10636 | 2/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.31 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.31 |
| ▸ | SYK | P43405 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Isobutane SCHEMBL27557774 | 0.83 | PHGDH (0.42) | PHGDHBRD4MAPTPTGS2 | |
| Isobutane SCHEMBL27558036 | 0.81 | SYK (0.39) | PHGDHBRD4MAPTKMT2APTGS2 | |
| SCHEMBL27624100 | 0.70 | HTT (0.35) | PHGDHBRD4MAPTKMT2AHRH3 | |
| SCHEMBL1924480 | 0.69 | NR1H2 (0.32) | KMT2A | |
| Isobutane SCHEMBL27575778 | 0.68 | KDM5B (0.37) | KMT2APTGS2 | |
| SCHEMBL27557708 | 0.66 | PSMB1 (0.35) | — | |
| SCHEMBL1925748 | 0.66 | NR1H2 (0.39) | PTGS2 | |
| SCHEMBL1925090 | 0.65 | PTGS2 (0.33) | PTGS2 | |
| SCHEMBL1924869 | 0.63 | PTGS2 (0.35) | BRD4KMT2APTGS2 | |
| SCHEMBL9796414 | 0.62 | CYP1A2 (0.32) | MAPTKMT2A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1759103-A | Water-soluble phenylpyridazine derivative and medicine containing the same | KOWA CO (JP) | 2006-04-12 | — | — | CN | disclosed |