Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 3/20 | 0.38 |
| ▸ | AKR1C2 | P52895 | 3/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 7/20 | 0.36 |
| ▸ | PTGS1 | P23219 | 5/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | ALOX5 | P09917 | 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 | |
|---|---|---|---|---|
| SCHEMBL5558932 | 0.89 | AKR1C3 (0.39) | AKR1C3AKR1C2PTGS2PTGS1ABCB1 | |
| SCHEMBL5808070 | 0.89 | AKR1C3 (0.48) | AKR1C3AKR1C2PTGS2PTGS1ABCB1 | |
| SCHEMBL5553916 | 0.88 | AKR1C3 (0.40) | AKR1C3AKR1C2PTGS2PTGS1HPGD | |
| SCHEMBL5553862 | 0.87 | AKR1C3 (0.51) | AKR1C3AKR1C2PTGS2PTGS1ABCB1 | |
| SCHEMBL5814553 | 0.87 | CNR1 (0.40) | AKR1C3AKR1C2PTGS2PTGS1HPGD | |
| SCHEMBL6423473 | 0.86 | PTGS2 (0.45) | AKR1C3AKR1C2PTGS2PTGS1ABCB1 | |
| SCHEMBL5558650 | 0.85 | PTGS2 (0.42) | AKR1C3AKR1C2PTGS2PTGS1 | |
| SCHEMBL5559282 | 0.83 | PTGS2 (0.42) | AKR1C3AKR1C2PTGS2PTGS1ABCB1 | |
| SCHEMBL5553794 | 0.83 | PTGS2 (0.44) | PTGS2PTGS1 | |
| SCHEMBL5554132 | 0.83 | PTGS2 (0.50) | PTGS2PTGS1HPGD |
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 |
|---|---|---|---|---|---|---|---|
| EP-1643961-A4 | COX-2 AND FAAH INHIBITORS | MICROBIA INC (US) | 2007-09-12 | — | — | EP | disclosed |
| EP-1643961-A2 | COX-2 AND FAAH INHIBITORS | Microbia, Inc. (US) | 2006-04-12 | — | — | EP | disclosed |
| WO-2005002525-A2 | COX-2 AND FAAH INHIBITORS | MICROBIA, INC. (US) | 2005-01-13 | — | — | WO | disclosed |