Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 3/20 | 0.31 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.30 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.30 |
| ▸ | IDO1 | P14902 | 1/20 | 0.30 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL5554440 | 0.93 | PTGS2 (0.32) | PTGS2AKR1C3AKR1C2 | |
| SCHEMBL5554202 | 0.86 | TACR3 (0.33) | PTGS2AKR1C3AKR1C2KCNH2 | |
| SCHEMBL5560527 | 0.84 | PTGS2 (0.33) | PTGS2AKR1C3AKR1C2IDO1KCNH2 | |
| SCHEMBL5560361 | 0.84 | IDO1 (0.30) | IDO1KCNH2 | |
| SCHEMBL5813879 | 0.82 | AKR1C3 (0.38) | PTGS2AKR1C3AKR1C2 | |
| SCHEMBL5797782 | 0.82 | — | — | |
| SCHEMBL5554454 | 0.81 | PTGS2 (0.40) | PTGS2AKR1C3AKR1C2 | |
| SCHEMBL5800435 | 0.81 | MAOB (0.35) | PTGS2AKR1C3AKR1C2 | |
| SCHEMBL5561193 | 0.80 | HPGD (0.34) | PTGS2AKR1C3AKR1C2 | |
| SCHEMBL5554427 | 0.79 | MEN1 (0.32) | PTGS2 |
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 |