Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | METAP2 | P50579 | 2/20 | 0.37 |
| ▸ | METAP1 | P53582 | 2/20 | 0.37 |
| ▸ | ACKR3 | P25106 | 1/20 | 0.36 |
| ▸ | DRD4 | P21917 | 2/20 | 0.34 |
| ▸ | CTSG | P08311 | 1/20 | 0.34 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.34 |
| ▸ | EPHX2 | P34913 | 3/20 | 0.34 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL206306 | 0.90 | METAP2 (0.42) | METAP2METAP1ACKR3DRD4CTSG | |
| SCHEMBL205964 | 0.89 | METAP2 (0.43) | METAP2METAP1DRD4EPHX2LMNA | |
| SCHEMBL206443 | 0.79 | EPHX2 (0.42) | SIGMAR1EPHX2THRBHPGDLMNA | |
| SCHEMBL207581 | 0.78 | POLB (0.46) | SIGMAR1EPHX2THRBHPGDKMT2A | |
| SCHEMBL206981 | 0.77 | DRD4 (0.41) | METAP2METAP1DRD4HPGDKMT2A | |
| SCHEMBL4081016 | 0.77 | EPHX2 (0.45) | SIGMAR1EPHX2THRBHPGD | |
| SCHEMBL205753 | 0.76 | SIGMAR1 (0.45) | SIGMAR1EPHX2THRBHPGD | |
| SCHEMBL206650 | 0.75 | KMT2A (0.44) | SIGMAR1EPHX2THRBHPGDKMT2A | |
| SCHEMBL4079658 | 0.75 | SSTR4 (0.43) | KMT2A | |
| SCHEMBL207872 | 0.75 | SIGMAR1 (0.46) | SIGMAR1EPHX2THRBHPGDLMNA |
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 |