Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MPO | P05164 | 5/20 | 0.47 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 4/20 | 0.34 |
| ▸ | RAB9A | P51151 | 4/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.33 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | TPO | P07202 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | EPX | P11678 | 1/20 | 0.32 |
| ▸ | PTGDR2 | Q9Y5Y4 | 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 | |
|---|---|---|---|---|
| SCHEMBL18621233 | 0.76 | MPO (0.54) | MPOSMN1; SMN2LMNAADORA2AMEN1 | |
| SCHEMBL18618875 | 0.72 | MPO (0.55) | MPOMEN1KMT2ATPOCYP3A4 | |
| SCHEMBL18620093 | 0.71 | MPO (0.56) | MPOADORA2ATPOEPX | |
| SCHEMBL18616416 | 0.70 | NOS3 (0.35) | — | |
| SCHEMBL18621231 | 0.69 | MPO (0.58) | MPO | |
| SCHEMBL18616406 | 0.68 | NOTUM (0.49) | MPONPC1RAB9ASMN1; SMN2LMNA | |
| SCHEMBL18618929 | 0.67 | MPO (0.55) | MPO | |
| SCHEMBL18616384 | 0.67 | MPO (0.60) | MPOTPOCYP3A4EPX | |
| SCHEMBL5517674 | 0.67 | HTR2A (0.50) | NPC1RAB9ASMN1; SMN2MAPTKMT2A | |
| SCHEMBL1875184 | 0.67 | CA2 (0.42) | MPOMAPT |
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 |