Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCKAR | P32238 | 16/20 | 0.65 |
| ▸ | SLC16A3 | O15427 | 1/20 | 0.49 |
| ▸ | SLC16A1 | P53985 | 1/20 | 0.49 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.45 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.45 |
| ▸ | BCL2 | P10415 | 2/20 | 0.42 |
| ▸ | MDM2 | Q00987 | 2/20 | 0.42 |
| ▸ | MCL1 | Q07820 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL4015199 | 0.87 | CCKAR (0.71) | CCKARPTGS2BCL2MDM2MCL1 | |
| SCHEMBL4005841 | 0.86 | CCKAR (0.70) | CCKARBCL2MDM2MCL1 | |
| SCHEMBL4009018 | 0.85 | CCKAR (0.74) | CCKARSLC16A3SLC16A1PTGS1PTGS2 | |
| SCHEMBL13980038 | 0.80 | CCKAR (0.64) | CCKARSLC16A3SLC16A1PTGS1PTGS2 | |
| SCHEMBL4137399 | 0.79 | CCKAR (1.00) | CCKARPTGS2 | |
| SCHEMBL4014758 | 0.79 | CCKAR (0.60) | CCKARSLC16A3SLC16A1PTGS1PTGS2 | |
| SCHEMBL4858502 | 0.78 | CCKAR (1.00) | CCKARPTGS1PTGS2 | |
| SCHEMBL4005418 | 0.78 | CCKAR (0.74) | CCKARSLC16A3SLC16A1PTGS2 | |
| SCHEMBL4012786 | 0.78 | CCKAR (0.60) | CCKARPTGS1PTGS2 | |
| SCHEMBL4007905 | 0.78 | CCKAR (0.60) | CCKARPTGS1PTGS2 |
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 |
|---|---|---|---|---|---|---|---|
| US-7037931-B2 | Corticotropin releasing factor moderator; analgesics; drug abruse, drug dependency; schizophrenia | JANSSEN PHARMACEUTICA N.V. (BE) | 2006-05-02 | — | — | US | disclosed |