Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MPO | P05164 | 18/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.42 |
| ▸ | EPX | P11678 | 2/20 | 0.37 |
| ▸ | TPO | P07202 | 3/20 | 0.35 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL19381435 | 0.87 | MPO (0.44) | MPOCYP3A4EPXTPOEPHX2 | |
| SCHEMBL19380923 | 0.73 | MPO (0.49) | MPOCYP3A4EPXSLC6A4 | |
| SCHEMBL19380947 | 0.71 | MPO (0.48) | MPOCYP3A4TPO | |
| SCHEMBL19381452 | 0.70 | MPO (0.47) | MPOCYP3A4TPOSLC6A4 | |
| SCHEMBL19381433 | 0.70 | GRIN2D (0.46) | MPOCYP3A4SLC6A4 | |
| SCHEMBL19380981 | 0.70 | MPO (0.39) | MPOCYP3A4EPXTPOSLC6A4 | |
| SCHEMBL19380881 | 0.68 | MPO (0.46) | MPOCYP3A4TPOSLC6A4 | |
| SCHEMBL19381018 | 0.68 | MPO (0.37) | MPOCYP3A4EPXTPO | |
| SCHEMBL19381400 | 0.68 | MPO (0.57) | MPOCYP3A4EPXTPO | |
| SCHEMBL19381014 | 0.67 | MPO (0.40) | MPOCYP3A4TPO |
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-2017161145-A1 | TRIAZOLOPYRIDINE INHIBITORS OF MYELOPEROXIDASE AND/OR EPX | BRISTOL-MYERS SQUIBB COMPANY (US) | 2017-09-21 | — | — | WO | disclosed |