Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NFKB1 | P19838 | 1/20 | 0.39 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.39 |
| ▸ | RELA | Q04206 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | GAA | P10253 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 5/20 | 0.35 |
| ▸ | CASP1 | P29466 | 1/20 | 0.35 |
| ▸ | CASP7 | P55210 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | SHMT2 | P34897 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.33 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.33 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 2/20 | 0.32 |
| ▸ | APP | P05067 | 1/20 | 0.32 |
| ▸ | MAOB | P27338 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | NQO1 | P15559 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL4043309 | 0.73 | APP (0.46) | NFKB1NFKB2RELAKDM4EGAA | |
| SCHEMBL1459582 | 0.72 | KDM4E (0.31) | KDM4EMAPTKMT2ANPC1RAB9A | |
| SCHEMBL266611 | 0.60 | MTNR1A (0.53) | NFKB1NFKB2RELAKDM4EGAA | |
| 1,2-Dimethoxybenzene SCHEMBL1796149 | 0.60 | CA1 (0.77) | KDM4EMAPTHSD17B10ALDH1A1POLB | |
| 1,2-Dimethoxybenzene SCHEMBL23113 | 0.60 | CA1 (0.77) | KDM4EMAPTHSD17B10ALDH1A1POLB | |
| SCHEMBL4718556 | 0.59 | JAK2 (0.38) | NR1H2NR1H3 | |
| SCHEMBL8434167 | 0.59 | ERN1 (0.47) | KDM4EMAPTCASP1CASP7HSD17B10 | |
| SCHEMBL9786951 | 0.57 | CYP3A4 (0.50) | KDM4EGAAMAPTCASP1CASP7 | |
| SCHEMBL15982610 | 0.56 | EP300 (0.46) | KDM4EGAAMAPTKMT2ANPC1 | |
| SCHEMBL15982615 | 0.56 | EP300 (0.46) | KDM4EGAAMAPTKMT2ANPC1 |
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-2010010186-A1 | NOVEL COMPOUNDS USEFUL FOR THE TREATMENT OF DEGENERATIVE AND INFLAMMATORY DISEASES | GALAPAGOS NV (BE) | 2010-01-28 | — | — | WO | disclosed |