Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.41 |
| ▸ | RAB9A | P51151 | 3/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.38 |
| ▸ | MTOR | P42345 | 1/20 | 0.38 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.37 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.37 |
| ▸ | RELA | Q04206 | 1/20 | 0.37 |
| ▸ | LTA4H | P09960 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | ATR | Q13535 | 1/20 | 0.35 |
| ▸ | LDHA | P00338 | 1/20 | 0.35 |
| ▸ | RARB | P10826 | 2/20 | 0.34 |
| ▸ | RARG | P13631 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 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 | |
|---|---|---|---|---|
| SCHEMBL4048443 | 0.82 | RORC (0.47) | ATRNOS3NOS1NOS2 | |
| SCHEMBL4050800 | 0.77 | ALDH1A1 (0.41) | SMN1; SMN2TP53ALDH1A1CYP1A2HSD17B10 | |
| SCHEMBL4056589 | 0.77 | ATR (0.40) | MTORATRHPGDMCHR1CHEK1 | |
| SCHEMBL4050702 | 0.75 | GPR119 (0.46) | MTORATRMCHR1 | |
| SCHEMBL13690530 | 0.74 | ATR (0.47) | SMN1; SMN2TSHRATRHPGDMCHR1 | |
| SCHEMBL4376368 | 0.74 | MKNK1 (0.46) | ATR | |
| SCHEMBL4374631 | 0.72 | ITGB3 (0.40) | LTA4HALDH1A1ATRKDM4EHPGD | |
| SCHEMBL4370431 | 0.72 | ATR (0.50) | SMN1; SMN2ALDH1A1ATRMCHR1 | |
| SCHEMBL4543729 | 0.72 | MCHR1 (0.43) | NPC1RAB9AALDH1A1CYP1A2HSD17B10 | |
| SCHEMBL4060086 | 0.72 | RORC (0.46) | PIK3CAMTORATRMCHR1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009106561-A1 | PYRAZINE COMPOUNDS FOR TREATING GPR119 RELATED DISORDERS | BIOVITRUM AB (PUBL) (SE) | 2009-09-03 | — | — | WO | disclosed |