Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.52 |
| ▸ | LMNA | P02545 | 5/20 | 0.46 |
| ▸ | TSHR | P16473 | 4/20 | 0.46 |
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.46 |
| ▸ | MEN1 | O00255 | 4/20 | 0.46 |
| ▸ | RAD52 | P43351 | 2/20 | 0.44 |
| ▸ | CNR2 | P34972 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 3/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL4734930 | 0.81 | ALDH1A1 (0.45) | ALDH1A1LMNAMAPTKMT2AMEN1 | |
| SCHEMBL8190064 | 0.80 | CYP3A4 (0.42) | LMNATSHRMAPTKMT2AMEN1 | |
| SCHEMBL3818747 | 0.79 | CNR2 (0.47) | ALDH1A1LMNAMAPTHTTCNR2 | |
| SCHEMBL8184199 | 0.78 | MAPK14 (0.44) | MAPTCNR2CYP3A4TP53 | |
| SCHEMBL4739106 | 0.78 | NPC1 (0.41) | MAPTKMT2AMEN1CNR2POLB | |
| SCHEMBL4738668 | 0.78 | CNR2 (0.40) | MAPTCNR2CYP3A4 | |
| SCHEMBL4733577 | 0.78 | TLR7 (0.40) | ALDH1A1LMNAMAPTCNR2CYP3A4 | |
| SCHEMBL3824123 | 0.78 | CNR1 (0.41) | ALDH1A1LMNAMAPTCNR2POLB | |
| SCHEMBL4733672 | 0.77 | ALDH1A1 (0.44) | ALDH1A1LMNACNR2SMN1; SMN2 | |
| SCHEMBL4736765 | 0.77 | CYP19A1 (0.43) | MAPTHTTCNR2CYP1A2TP53 |
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-2008073461-A2 | ION CHANNEL MODULATORS | WYETH (US) | 2008-06-19 | — | — | WO | claimed |