Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MPO | P05164 | 5/20 | 0.52 |
| ▸ | NOS2 | P35228 | 6/20 | 0.34 |
| ▸ | NOS3 | P29474 | 4/20 | 0.34 |
| ▸ | NOS1 | P29475 | 3/20 | 0.34 |
| ▸ | TPO | P07202 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | EPX | P11678 | 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 | |
|---|---|---|---|---|
| SCHEMBL18618945 | 0.87 | RAB9A (0.41) | MPOTPOCYP3A4EPX | |
| SCHEMBL18618819 | 0.80 | MPO (0.51) | MPOTPOCYP3A4EPX | |
| SCHEMBL18616416 | 0.79 | NOS3 (0.35) | NOS2NOS3NOS1 | |
| SCHEMBL18620324 | 0.78 | MPO (0.53) | MPOTPOCYP3A4EPX | |
| SCHEMBL18620305 | 0.75 | MPO (0.55) | MPOTPOCYP3A4EPX | |
| SCHEMBL18618875 | 0.75 | MPO (0.55) | MPOTPOCYP3A4EPX | |
| SCHEMBL18618877 | 0.75 | MPO (0.55) | MPO | |
| SCHEMBL18621231 | 0.75 | MPO (0.58) | MPO | |
| SCHEMBL18620663 | 0.74 | MPO (0.56) | MPONOS2NOS3NOS1CYP3A4 | |
| SCHEMBL18618884 | 0.72 | MPO (0.60) | MPO |
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-2017040451-A1 | TRIAZOLOPYRIDINE INHIBITORS OF MYELOPEROXIDASE | BRISTOL-MYERS SQUIBB COMPANY (US) | 2017-03-09 | — | — | WO | disclosed |