Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 2/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.48 |
| ▸ | APP | P05067 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | MMP9 | P14780 | 3/20 | 0.42 |
| ▸ | MMP2 | P08253 | 2/20 | 0.42 |
| ▸ | MMP8 | P22894 | 2/20 | 0.42 |
| ▸ | MMP12 | P39900 | 2/20 | 0.42 |
| ▸ | MMP13 | P45452 | 2/20 | 0.42 |
| ▸ | MMP14 | P50281 | 2/20 | 0.42 |
| ▸ | MMP16 | P51512 | 2/20 | 0.42 |
| ▸ | MMP1 | P03956 | 1/20 | 0.42 |
| ▸ | PTGS2 | P35354 | 6/20 | 0.42 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.40 |
| ▸ | AKR1C2 | P52895 | 2/20 | 0.40 |
| ▸ | CXCL8 | P10145 | 1/20 | 0.39 |
| ▸ | PTGS1 | P23219 | 4/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | FABP2 | P12104 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8148942 | 0.87 | PTGS2 (0.51) | CYP2C9CYP2C19APPCYP3A4MMP9 | |
| SCHEMBL1679287 | 0.85 | CYP2C19 (0.52) | CYP2C9CYP2C19APPCYP3A4MMP9 | |
| SCHEMBL1679080 | 0.83 | MMP2 (0.55) | CYP2C19APPMMP9MMP2MMP8 | |
| SCHEMBL1678823 | 0.82 | PDE4A (0.45) | CYP2C9CYP2C19APPCYP3A4MMP9 | |
| SCHEMBL1679486 | 0.78 | CYP2C19 (0.46) | CYP2C9CYP2C19APPCYP3A4MMP9 | |
| SCHEMBL28755926 | 0.77 | PTGS2 (0.51) | CYP2C9CYP2C19MMP9MMP2MMP8 | |
| SCHEMBL1678652 | 0.77 | ALDH1A1 (0.40) | CYP3A4MMP9PTGS2MEN1KMT2A | |
| SCHEMBL16581454 | 0.76 | ABL1 (0.52) | APPMEN1KMT2AMAPTHPGD | |
| SCHEMBL1679276 | 0.76 | CYP2C9 (0.50) | CYP2C9CYP2C19APPCYP3A4PTGS2 | |
| SCHEMBL7102472 | 0.75 | PTGS2 (0.47) | CYP3A4MMP9MMP2MMP8MMP12 |
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 |