Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHODH | Q02127 | 3/20 | 0.35 |
| ▸ | CCR2 | P41597 | 3/20 | 0.33 |
| ▸ | NR1H4 | Q96RI1 | 2/20 | 0.33 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | THRB | P10828 | 1/20 | 0.31 |
| ▸ | SSTR1 | P30872 | 1/20 | 0.31 |
| ▸ | SSTR4 | P31391 | 1/20 | 0.31 |
| ▸ | BCL2L11 | O43521 | 1/20 | 0.31 |
| ▸ | BCL2 | P10415 | 1/20 | 0.31 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.31 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL5159882 | 0.95 | EPHX2 (0.36) | DHODHCCR2NR1H4TRPV1 | |
| SCHEMBL4083007 | 0.83 | DHODH (0.45) | DHODHMEN1KMT2ATHRBNPSR1 | |
| SCHEMBL206128 | 0.82 | SSTR1 (0.39) | CCR2NR1H4MEN1KMT2ATHRB | |
| SCHEMBL206834 | 0.80 | DHODH (0.48) | DHODHPOLBMEN1KMT2ATHRB | |
| SCHEMBL206685 | 0.80 | EPHX2 (0.43) | POLBKMT2ATP53MAPTTHRB | |
| SCHEMBL206533 | 0.80 | CYP2C9 (0.42) | CCR2NR1H4POLBKMT2ATHRB | |
| SCHEMBL205814 | 0.80 | LMNA (0.44) | DHODHPOLBMEN1KMT2ATP53 | |
| SCHEMBL207581 | 0.79 | POLB (0.46) | NR1H4POLBKMT2ATP53MAPT | |
| SCHEMBL206643 | 0.79 | SSTR4 (0.43) | NR1H4MEN1KMT2ASSTR1SSTR4 | |
| SCHEMBL207293 | 0.78 | DHODH (0.48) | DHODHPOLBMEN1KMT2A |
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 |