Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 2/20 | 0.39 |
| ▸ | RORC | P51449 | 1/20 | 0.36 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.36 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.35 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.35 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | PIM1 | P11309 | 1/20 | 0.35 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.35 |
| ▸ | CCR1 | P32246 | 1/20 | 0.34 |
| ▸ | CCR5 | P51681 | 1/20 | 0.34 |
| ▸ | CCR8 | P51685 | 1/20 | 0.34 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.34 |
| ▸ | GCK | P35557 | 1/20 | 0.34 |
| ▸ | GCKR | Q14397 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL28797115 | 0.79 | PTGS2 (0.40) | PTGS2RORCENPP2PTGDR2KCNH2 | |
| SCHEMBL28794293 | 0.78 | CA2 (0.46) | PTGS2RORCENPP2PTGDR2KDM4E | |
| SCHEMBL903915 | 0.78 | ENPP2 (0.55) | PTGS2ENPP2PTGDR2CYP4F2CYP4A11 | |
| SCHEMBL20068615 | 0.77 | CCR1 (0.46) | KDM4ECCR1CCR5CCR8HDAC6 | |
| SCHEMBL28004660 | 0.76 | PTGS2 (0.51) | PTGS2KDM4ECCR1CCR5CCR8 | |
| SCHEMBL8313419 | 0.76 | ENPP2 (0.41) | PTGS2ENPP2KDM4E | |
| SCHEMBL13589551 | 0.74 | RORC (0.53) | PTGS2RORC | |
| SCHEMBL2440973 | 0.73 | RORC (0.43) | PTGS2RORCENPP2PTGDR2KCNH2 | |
| SCHEMBL19187290 | 0.73 | PTGS2 (0.55) | PTGS2RORC | |
| SCHEMBL14378767 | 0.73 | PTGS2 (0.48) | PTGS2RORCPIM1PIM2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012041158-A1 | TRICYCLIC COMPOUND, PREPARATION METHOD AND PHARMACEUTICAL USE THEREOF | 上海恒瑞医药有限公司 (CN) | 2012-04-05 | — | — | WO | disclosed |