Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRL1 | P41146 | 7/20 | 0.48 |
| ▸ | OPRM1 | P35372 | 6/20 | 0.48 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.33 |
| ▸ | KDM1A | O60341 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL4076511 | 0.84 | OPRL1 (0.59) | OPRL1OPRM1 | |
| Methylamine SCHEMBL27747656 | 0.71 | IDO1 (0.52) | — | |
| SCHEMBL29395342 | 0.71 | IDO1 (0.55) | — | |
| SCHEMBL29858363 | 0.71 | IDO1 (0.55) | — | |
| SCHEMBL42780 | 0.71 | IDO1 (0.55) | — | |
| SCHEMBL28840240 | 0.71 | IDO1 (0.55) | — | |
| SCHEMBL42279 | 0.71 | IDO1 (0.55) | — | |
| SCHEMBL6600 | 0.71 | IDO1 (0.55) | — | |
| SCHEMBL12787610 | 0.71 | IDO1 (0.55) | — | |
| SCHEMBL20866603 | 0.70 | OPRL1 (0.59) | OPRL1OPRM1 |
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-1745010-B1 | SUBSTITUTED CYCLOHEXYL-1,4-DIAMINE DERIVATIVES | GRUENENTHAL GMBH (DE) | 2009-08-05 | — | — | EP | claimed |