Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 7/20 | 0.58 |
| ▸ | KDM5B | Q9UGL1 | 2/20 | 0.56 |
| ▸ | POLB | P06746 | 2/20 | 0.55 |
| ▸ | RXRA | P19793 | 1/20 | 0.51 |
| ▸ | RXRB | P28702 | 1/20 | 0.51 |
| ▸ | RXRG | P48443 | 1/20 | 0.51 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.49 |
| ▸ | RPA1 | P27694 | 1/20 | 0.48 |
| ▸ | MMP2 | P08253 | 1/20 | 0.47 |
| ▸ | MMP8 | P22894 | 1/20 | 0.47 |
| ▸ | MMP12 | P39900 | 1/20 | 0.47 |
| ▸ | MMP13 | P45452 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL9988404 | 0.95 | PTGS2 (0.59) | PTGS2KDM5BPOLBRXRARXRB | |
| SCHEMBL9988387 | 0.88 | DRD4 (0.49) | PTGS2KDM5BPOLBKDM4EHSD17B10 | |
| SCHEMBL9989269 | 0.86 | PTGS2 (0.54) | PTGS2POLBRXFP1KDM4E | |
| SCHEMBL9989347 | 0.85 | RXRA (0.49) | PTGS2RXRARXRBRXRGALOX5 | |
| SCHEMBL9988533 | 0.83 | LMNA (0.49) | PTGS2KDM5BPOLBRXRARXRB | |
| SCHEMBL9988392 | 0.82 | MC4R (0.57) | PTGS2RXRARXRBRXRGALOX5 | |
| SCHEMBL9989304 | 0.81 | RXRA (0.52) | PTGS2POLBRXRARXRBRXRG | |
| SCHEMBL9989355 | 0.81 | MALT1 (0.62) | PTGS2RXRARXRBRXRGKDM4E | |
| SCHEMBL9989408 | 0.79 | DRD4 (0.51) | POLBRXRARXRBRXRGKDM4E | |
| SCHEMBL9988308 | 0.78 | MALT1 (0.55) | PTGS2RXRARXRBRXRGALDH1A1 |
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-2011161615-A1 | 5-LIPOXYGENASE INHIBITORS | RANBAXY LABORATORIES LIMITED (IN) | 2011-12-29 | — | — | WO | disclosed |