Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP13 | P45452 | 7/20 | 0.47 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.42 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.42 |
| ▸ | WDR5 | P61964 | 3/20 | 0.41 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.41 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.40 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.39 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.39 |
| ▸ | XDH | P47989 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8055185 | 0.90 | MMP13 (0.54) | MMP13EPHX2NR1H4KDM4CXDH | |
| SCHEMBL3696323 | 0.89 | MMP13 (0.44) | MMP13EPHX2NR1H4KDM4CXDH | |
| SCHEMBL3690556 | 0.89 | MMP13 (0.44) | MMP13EPHX2NR1H4KDM4CXDH | |
| SCHEMBL3686913 | 0.87 | MMP13 (0.58) | MMP13 | |
| SCHEMBL8070170 | 0.85 | MMP13 (0.61) | MMP13EPHX2NR1H4 | |
| SCHEMBL8071850 | 0.84 | MMP13 (0.52) | MMP13EPHX2NR1H4KDM4CXDH | |
| SCHEMBL8061043 | 0.84 | MMP13 (0.51) | MMP13HDAC3HDAC1HDAC2HDAC6 | |
| SCHEMBL3765203 | 0.79 | MMP13 (0.57) | MMP13 | |
| SCHEMBL8058261 | 0.77 | MMP13 (0.51) | MMP13XDH | |
| SCHEMBL8056592 | 0.75 | MMP13 (0.59) | MMP13EPHX2NR1H4 |
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-2009016498-A1 | PYRIMIDINE AND PYRIDINE DERIVATIVES AND THEIR PHARMACEUTICAL USE AND COMPOSITIONS | PFIZER INC. (US) | 2009-02-05 | — | — | WO | disclosed |