Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.37 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.36 |
| ▸ | HTR2B | P41595 | 1/20 | 0.35 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.35 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.35 |
| ▸ | GSK3B | P49841 | 1/20 | 0.35 |
| ▸ | NAMPT | P43490 | 1/20 | 0.35 |
| ▸ | RIPK2 | O43353 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4786833 | 0.74 | ALDH1A1 (0.44) | ALDH1A1HTTCYP11B2PRMT5OPRK1 | |
| SCHEMBL17555503 | 0.73 | L3MBTL4 (0.43) | ALDH1A1HTTCYP11B2EPHX2 | |
| SCHEMBL19473362 | 0.69 | PRMT5 (0.45) | ALDH1A1HTTCYP11B2PRMT5OPRK1 | |
| SCHEMBL2305909 | 0.69 | EPHX2 (0.63) | ALDH1A1HTTEPHX2 | |
| SCHEMBL17559499 | 0.68 | PRMT5 (0.44) | ALDH1A1HTTCYP11B2PRMT5OPRK1 | |
| SCHEMBL639198 | 0.68 | EPHX2 (0.60) | ALDH1A1HTTEPHX2NAMPT | |
| SCHEMBL28886445 | 0.67 | HTT (0.51) | ALDH1A1HTTNPC1RAB9A | |
| SCHEMBL1117853 | 0.67 | RAB9A (0.62) | ALDH1A1HTTNPC1RAB9ANAMPT | |
| SCHEMBL17559339 | 0.67 | PRMT5 (0.45) | ALDH1A1HTTCYP11B2PRMT5EPHX2 | |
| SCHEMBL4745663 | 0.67 | GPR119 (0.53) | — |
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-2008109613-A1 | BENZO[C][2,7]NAPHTHYRIDINE DERIVATIVES, AND THEIR USE AS KINASE INHIBITORS | WYETH (US) | 2008-09-12 | — | — | WO | disclosed |