Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 1/20 | 0.54 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.54 |
| ▸ | CNR1 | P21554 | 3/20 | 0.47 |
| ▸ | CNR2 | P34972 | 3/20 | 0.47 |
| ▸ | TUBB1 | Q9H4B7 | 1/20 | 0.46 |
| ▸ | PPARG | P37231 | 3/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | CCR2 | P41597 | 1/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.37 |
| ▸ | ELANE | P08246 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL5271495 | 0.88 | AKR1C3 (0.72) | AKR1C3AKR1C2CNR2TUBB1PPARG | |
| SCHEMBL7873596 | 0.84 | AKR1C3 (0.52) | AKR1C3AKR1C2CNR1CNR2TUBB1 | |
| SCHEMBL7871834 | 0.83 | AKR1C3 (0.52) | AKR1C3AKR1C2CNR1CNR2TUBB1 | |
| SCHEMBL5267225 | 0.81 | AKR1C3 (0.74) | AKR1C3AKR1C2CNR2TUBB1PPARG | |
| SCHEMBL5266647 | 0.80 | AKR1C3 (0.70) | AKR1C3AKR1C2CNR2TUBB1PPARG | |
| SCHEMBL5269541 | 0.79 | AKR1C3 (0.74) | AKR1C3AKR1C2CNR2TUBB1PPARG | |
| SCHEMBL5269841 | 0.78 | AKR1C3 (0.73) | AKR1C3AKR1C2CNR2TUBB1PPARG | |
| SCHEMBL5270746 | 0.77 | AKR1C3 (0.72) | AKR1C3AKR1C2CNR2TUBB1PPARG | |
| SCHEMBL5268019 | 0.75 | AKR1C3 (0.70) | AKR1C3AKR1C2TUBB1PPARGKDM4E | |
| SCHEMBL4588225 | 0.74 | AKR1C3 (0.67) | AKR1C3AKR1C2TUBB1PPARGKDM4E |
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-6306890-B1 | COMPOUNDS FOR INHIBITING CYCLOOXYGENASE | VANDERBILT UNIVERSITY | 2001-10-23 | — | — | US | disclosed |