Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | ESR1 | P03372 | 1/20 | 0.42 |
| ▸ | TNKS2 | Q9H2K2 | 8/20 | 0.41 |
| ▸ | CRHR1 | P34998 | 3/20 | 0.40 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.40 |
| ▸ | TNKS | O95271 | 4/20 | 0.40 |
| ▸ | PDE4B | Q07343 | 6/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | HTR1A | P08908 | 1/20 | 0.36 |
| ▸ | DRD2 | P14416 | 1/20 | 0.36 |
| ▸ | HTR7 | P34969 | 1/20 | 0.36 |
| ▸ | HTR6 | P50406 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL20118187 | 0.91 | PDE4B (0.41) | TNKS2CRHR1CRHR2TNKSPDE4B | |
| SCHEMBL20118132 | 0.90 | LMNA (0.46) | LMNAESR1TNKS2CRHR1CRHR2 | |
| SCHEMBL20118407 | 0.83 | PDE4B (0.40) | CRHR1CRHR2PDE4BHTR1A | |
| SCHEMBL20118188 | 0.82 | KDM4E (0.47) | TNKS | |
| SCHEMBL20118174 | 0.82 | CRHR1 (0.40) | CRHR1CRHR2PDE4BHPGD | |
| SCHEMBL20118184 | 0.82 | CRHR1 (0.39) | CRHR1CRHR2PDE4BHPGD | |
| SCHEMBL20103438 | 0.80 | LMNA (0.44) | LMNAESR1TNKS2CRHR1CRHR2 | |
| SCHEMBL20103162 | 0.79 | LMNA (0.43) | LMNAESR1TNKS2CRHR1CRHR2 | |
| SCHEMBL20118220 | 0.77 | ALDH1A1 (0.50) | CRHR1CRHR2PDE4BHPGD | |
| SCHEMBL20118231 | 0.77 | CRHR1 (0.37) | CRHR1CRHR2HPGDHTR1A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018078009-A1 | AMIDO-SUBSTITUTED CYCLOHEXANE DERIVATIVES | BAYER PHARMA AKTIENGESELLSCHAFT (DE) | 2018-05-03 | — | — | WO | disclosed |