Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.36 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.35 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.32 |
| ▸ | PGR | P06401 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | USP2 | O75604 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL5822558 | 0.93 | PTGS2 (0.34) | TSHRPTGS2CYP19A1KCNH2 | |
| SCHEMBL5796692 | 0.91 | PTGS2 (0.37) | PTGS2HSD11B1ALDH1A1CYP19A1KMT2A | |
| SCHEMBL5801005 | 0.91 | PTGS2 (0.44) | PTGS2CYP19A1SMN1; SMN2 | |
| SCHEMBL5800554 | 0.90 | PTGS2 (0.38) | TSHRPTGS2HSD11B1SIGMAR1CYP1A2 | |
| SCHEMBL5801342 | 0.90 | PTGS2 (0.35) | PTGS2HSD11B1ALDH1A1CYP19A1KMT2A | |
| SCHEMBL5559471 | 0.90 | PTGS2 (0.42) | PTGS2 | |
| SCHEMBL5798160 | 0.89 | L3MBTL1 (0.37) | PTGS2HSD11B1ALDH1A1CYP19A1SLC6A3 | |
| SCHEMBL5800295 | 0.88 | TSHR (0.36) | TSHRPTGS2HSD11B1SIGMAR1CYP1A2 | |
| SCHEMBL5797664 | 0.88 | LMNA (0.38) | PTGS2HSD11B1CYP3A4ALDH1A1CYP19A1 | |
| SCHEMBL5800837 | 0.87 | L3MBTL1 (0.37) | PTGS2HSD11B1ALDH1A1SLC6A3SLC6A2 |
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 4 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 |
| WO-2006050120-A2 | SYNTHESIS OF COX-2 AND FAAH INHIBITORS | MICROBIA, INC. (US) | 2006-05-11 | — | — | WO | 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 |