Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP4F2 | P78329 | 2/20 | 0.42 |
| ▸ | CYP4A11 | Q02928 | 2/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.31 |
| ▸ | CPT2 | P23786 | 1/20 | 0.31 |
| ▸ | ACHE | P22303 | 6/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL22952840 | 0.87 | CES2 (0.40) | HSD17B10MEN1KMT2A | |
| SCHEMBL8061619 | 0.87 | CES2 (0.40) | HSD17B10MEN1KMT2A | |
| SCHEMBL217945 | 0.78 | ALDH1A1 (0.38) | TDP1KDM4EALDH1A1HTT | |
| SCHEMBL8040934 | 0.77 | CES2 (0.39) | HSD17B10MEN1KMT2A | |
| SCHEMBL28387319 | 0.75 | CYP4F2 (0.44) | CYP4F2CYP4A11TDP1KDM4ESMN1; SMN2 | |
| SCHEMBL24013320 | 0.74 | CES1 (0.39) | HSD17B10MEN1KMT2A | |
| SCHEMBL12801895 | 0.72 | CYP4F2 (0.41) | CYP4F2CYP4A11TDP1KDM4ESMN1; SMN2 | |
| SCHEMBL13400170 | 0.72 | FFAR1 (0.39) | CYP4F2CYP4A11TDP1MEN1KMT2A | |
| SCHEMBL24276109 | 0.72 | CES2 (0.41) | HSD17B10MEN1KMT2A | |
| SCHEMBL27300515 | 0.69 | CYP4F2 (0.39) | CYP4F2CYP4A11TDP1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1001944-B1 | PYRAZINE DERIVATIVES, PREPARATION AND MEDICINES CONTAINING THEM | AVENTIS PHARMA SA (FR) | 2003-10-01 | — | — | EP | disclosed |