Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 6/20 | 0.40 |
| ▸ | OPRD1 | P41143 | 6/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.36 |
| ▸ | CNR1 | P21554 | 2/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL5158319 | 0.88 | YAP1 (0.34) | OPRM1OPRD1SIGMAR1KDM4EALDH1A1 | |
| SCHEMBL205784 | 0.86 | MEN1 (0.49) | OPRM1MAPTLMNAHTTKMT2A | |
| SCHEMBL207973 | 0.85 | CNR1 (0.46) | OPRM1OPRD1MAPTKMT2ASIGMAR1 | |
| SCHEMBL205169 | 0.84 | SIGMAR1 (0.41) | MAPTLMNAHTTNPSR1KMT2A | |
| SCHEMBL5154785 | 0.82 | KMT2A (0.36) | OPRM1OPRD1MAPTLMNAHTT | |
| SCHEMBL207488 | 0.82 | MEN1 (0.47) | OPRM1MAPTLMNAHTTNPSR1 | |
| SCHEMBL206590 | 0.79 | MEN1 (0.47) | OPRM1MAPTLMNAHTTNPSR1 | |
| SCHEMBL206160 | 0.79 | ALDH1A1 (0.49) | OPRM1OPRD1MAPTKMT2AMEN1 | |
| SCHEMBL208300 | 0.79 | LMNA (0.50) | LMNAKMT2AMEN1CNR1TP53 | |
| SCHEMBL207909 | 0.78 | HDAC3 (0.45) | OPRM1OPRD1LMNAKMT2ASIGMAR1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1745010-A1 | SUBSTITUTED CYCLOHEXYL-1,4-DIAMINE DERIVATIVES | Grünenthal GmbH (DE) | 2007-01-24 | — | — | EP | disclosed |
| WO-2005110974-A1 | SUBSTITUTED CYCLOHEXYL-1,4-DIAMINE DERIVATIVES | Grünenthal GmbH (DE) | 2005-11-24 | — | — | WO | disclosed |