Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AVPR1A | P37288 | 10/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | OXTR | P30559 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 4/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | NOS2 | P35228 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL209932 | 0.92 | AVPR1A (0.44) | AVPR1AOXTRKMT2A | |
| SCHEMBL208694 | 0.88 | AVPR1A (0.41) | AVPR1AL3MBTL1OXTR | |
| SCHEMBL207560 | 0.83 | POLB (0.41) | AVPR1AKMT2A | |
| SCHEMBL4049886 | 0.82 | MAPT (0.45) | ATML3MBTL1HDAC1HDAC6KMT2A | |
| SCHEMBL208300 | 0.81 | LMNA (0.50) | KMT2A | |
| SCHEMBL206987 | 0.80 | POLB (0.56) | KMT2A | |
| SCHEMBL4079453 | 0.80 | LMNA (0.43) | AVPR1AOXTR | |
| SCHEMBL206402 | 0.80 | ALDH1A1 (0.41) | L3MBTL1HDAC1HDAC6KMT2A | |
| SCHEMBL4084189 | 0.79 | HRH3 (0.40) | L3MBTL1HDAC1HDAC6KMT2A | |
| SCHEMBL2983415 | 0.79 | MEN1 (0.45) | L3MBTL1HDAC1HDAC6KMT2A |
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-B1 | SUBSTITUTED CYCLOHEXYL-1,4-DIAMINE DERIVATIVES | GRUENENTHAL GMBH (DE) | 2009-08-05 | — | — | EP | claimed |
| EP-1745010-B1 | SUBSTITUTED CYCLOHEXYL-1,4-DIAMINE DERIVATIVES | GRUENENTHAL GMBH (DE) | 2009-08-05 | — | — | EP | disclosed |