Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 6/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 6/20 | 0.38 |
| ▸ | LDHA | P00338 | 1/20 | 0.38 |
| ▸ | FPR2 | P25090 | 3/20 | 0.37 |
| ▸ | MMP1 | P03956 | 2/20 | 0.36 |
| ▸ | MMP2 | P08253 | 2/20 | 0.36 |
| ▸ | MMP3 | P08254 | 2/20 | 0.36 |
| ▸ | MMP7 | P09237 | 2/20 | 0.36 |
| ▸ | MMP9 | P14780 | 2/20 | 0.36 |
| ▸ | MMP13 | P45452 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | FPR1 | P21462 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | PPARA | Q07869 | 2/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | MMP14 | P50281 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL1678995 | 0.80 | GRM1 (0.41) | PTGS1PTGS2FPR2ALDH1A1PPARA | |
| SCHEMBL9437482 | 0.80 | CYP3A4 (0.42) | PTGS1PTGS2 | |
| SCHEMBL8157598 | 0.80 | GRM1 (0.41) | PTGS1PTGS2FPR2ALDH1A1PPARA | |
| SCHEMBL38661512 | 0.79 | KDM4E (0.46) | PTGS1PTGS2KDM4EPPARAHTT | |
| SCHEMBL20943279 | 0.79 | MAPK1 (0.46) | PTGS1PTGS2ALDH1A1KDM4ELMNA | |
| SCHEMBL38663319 | 0.79 | PTGS2 (0.38) | PTGS1PTGS2LDHAKDM4EPPARA | |
| SCHEMBL8163812 | 0.79 | MAPK1 (0.46) | PTGS1PTGS2ALDH1A1KDM4ELMNA | |
| SCHEMBL1679175 | 0.79 | PTGS1 (0.51) | PTGS1PTGS2FPR2MMP1MMP2 | |
| SCHEMBL28101655 | 0.78 | APP (0.40) | ALDH1A1SMN1; SMN2LMNA | |
| SCHEMBL1679346 | 0.77 | AKR1C3 (0.41) | PTGS1PTGS2FPR2ALDH1A1KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| US-7923573-B2 | Benzene compound having 2 or more substituents | DAIICHI SANKYO COMPANY, LIMITED (JP) | 2011-04-12 | — | — | US | disclosed |