Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.38 |
| ▸ | PPARG | P37231 | 1/20 | 0.38 |
| ▸ | PPARA | Q07869 | 1/20 | 0.38 |
| ▸ | FFAR2 | O15552 | 1/20 | 0.37 |
| ▸ | GHSR | Q92847 | 2/20 | 0.37 |
| ▸ | OPRM1 | P35372 | 3/20 | 0.37 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 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 | |
|---|---|---|---|---|
| SCHEMBL5162540 | 0.86 | MCHR1 (0.46) | SIGMAR1POLB | |
| SCHEMBL2989322 | 0.82 | MEN1 (0.48) | MAPTSIGMAR1PPARGPPARAOPRM1 | |
| SCHEMBL2976658 | 0.81 | MEN1 (0.45) | ALDH1A1MAPTSIGMAR1PPARGPPARA | |
| SCHEMBL2984800 | 0.81 | ALDH1A1 (0.48) | ALDH1A1MAPTSIGMAR1FFAR2GHSR | |
| SCHEMBL2982908 | 0.79 | MCHR1 (0.50) | SIGMAR1POLB | |
| SCHEMBL2976726 | 0.77 | MCHR1 (0.54) | SIGMAR1POLB | |
| SCHEMBL2972799 | 0.77 | TSHR (0.52) | ALDH1A1MAPTGHSROPRM1 | |
| SCHEMBL2987754 | 0.75 | POLB (0.50) | ALDH1A1SIGMAR1OPRM1KMT2APOLB | |
| SCHEMBL2972810 | 0.75 | ATF4 (0.55) | SIGMAR1KMT2APOLB | |
| SCHEMBL5162405 | 0.74 | PPARG (0.39) | ALDH1A1SIGMAR1PPARGPPARAKMT2A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-2007536322-A | — | — | 2007-12-13 | — | — | JP | claimed |
| EP-1747191-A1 | SUBSTITUTED CYCLOHEXYL-1,4-DIAMINE DERIVATIVES WITH A CHAIN EXTENSION | Grünenthal GmbH (DE) | 2007-01-31 | — | — | EP | claimed |
| WO-2005110975-A1 | SUBSTITUTED CYCLOHEXYL-1,4-DIAMINE DERIVATIVES WITH A CHAIN EXTENSION | Grünenthal GmbH (DE) | 2005-11-24 | — | — | WO | claimed |