Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4A | P27815 | 10/20 | 0.66 |
| ▸ | PDE4B | Q07343 | 10/20 | 0.66 |
| ▸ | PDE4C | Q08493 | 10/20 | 0.66 |
| ▸ | PDE4D | Q08499 | 10/20 | 0.66 |
| ▸ | TAS1R3 | Q7RTX0 | 6/20 | 0.65 |
| ▸ | TAS1R1 | Q7RTX1 | 6/20 | 0.65 |
| ▸ | BCL2L1 | Q07817 | 2/20 | 0.56 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL8323597 | 1.00 | PDE4A (0.66) | PDE4APDE4BPDE4CPDE4DTAS1R3 | |
| SCHEMBL19083995 | 0.87 | TAS1R3 (0.62) | PDE4APDE4BPDE4CPDE4DTAS1R3 | |
| SCHEMBL7450501 | 0.83 | PDE4D (0.75) | PDE4APDE4BPDE4CPDE4DEPHX2 | |
| SCHEMBL202816 | 0.82 | PDE4D (0.74) | PDE4APDE4BPDE4CPDE4DEPHX2 | |
| SCHEMBL7512973 | 0.82 | PDE4D (0.74) | PDE4APDE4BPDE4CPDE4DEPHX2 | |
| SCHEMBL7424332 | 0.81 | PDE4D (0.60) | PDE4APDE4BPDE4CPDE4DEPHX2 | |
| SCHEMBL703468 | 0.79 | TAS1R3 (1.00) | TAS1R3TAS1R1BCL2L1 | |
| SCHEMBL703467 | 0.79 | TAS1R3 (1.00) | TAS1R3TAS1R1BCL2L1 | |
| SCHEMBL700708 | 0.79 | TAS1R3 (1.00) | TAS1R3TAS1R1BCL2L1 | |
| SCHEMBL700709 | 0.79 | TAS1R3 (1.00) | TAS1R3TAS1R1BCL2L1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1998056756-A1 | CATECHOL AMINO ACID DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | CHEIL JEDANG CORPORATION (KR) | 1998-12-17 | — | — | WO | claimed |
| EP-2193808-A1 | Synergistic combination | Nycomed GmbH (DE) | 2010-06-09 | — | — | EP | disclosed |
| WO-1998056756-A1 | CATECHOL AMINO ACID DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | CHEIL JEDANG CORPORATION (KR) | 1998-12-17 | — | — | WO | disclosed |