Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 8/20 | 0.55 |
| ▸ | PTGS2 | P35354 | 11/20 | 0.53 |
| ▸ | CNR2 | P34972 | 1/20 | 0.53 |
| ▸ | AKR1C2 | P52895 | 5/20 | 0.52 |
| ▸ | HTR1A | P08908 | 1/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.43 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.43 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL5554589 | 0.90 | AKR1C3 (0.53) | AKR1C3PTGS2AKR1C2PTGS1GLO1 | |
| SCHEMBL6427040 | 0.90 | PTGS2 (0.53) | AKR1C3PTGS2AKR1C2PTGS1 | |
| SCHEMBL6426695 | 0.89 | PTGS2 (0.52) | AKR1C3PTGS2CNR2AKR1C2PTGS1 | |
| SCHEMBL5554002 | 0.88 | PTGS2 (0.47) | AKR1C3PTGS2AKR1C2PTGS1 | |
| SCHEMBL5554131 | 0.88 | PTGS2 (0.46) | AKR1C3PTGS2AKR1C2 | |
| SCHEMBL5561166 | 0.86 | PTGS2 (0.56) | AKR1C3PTGS2AKR1C2PTGS1 | |
| SCHEMBL5559748 | 0.86 | PTGS2 (0.45) | AKR1C3PTGS2AKR1C2PTGS1 | |
| SCHEMBL5553844 | 0.86 | PTGS2 (0.49) | AKR1C3PTGS2AKR1C2PTGS1 | |
| SCHEMBL5553932 | 0.86 | PTGS2 (0.49) | AKR1C3PTGS2AKR1C2PTGS1 | |
| SCHEMBL5558197 | 0.86 | PTGS2 (0.48) | AKR1C3PTGS2AKR1C2 |
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 |