Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MPO | P05164 | 6/20 | 0.64 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.64 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.51 |
| ▸ | MEN1 | O00255 | 6/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.48 |
| ▸ | MITF | O75030 | 1/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | BCHE | P06276 | 2/20 | 0.45 |
| ▸ | BACE1 | P56817 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | HTR1A | P08908 | 1/20 | 0.43 |
| ▸ | CNR1 | P21554 | 1/20 | 0.43 |
| ▸ | HTR7 | P34969 | 1/20 | 0.43 |
| ▸ | HTR6 | P50406 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL19359152 | 1.00 | MPO (0.64) | MPOCYP3A4KCNH2MEN1KMT2A | |
| SCHEMBL3641265 | 0.84 | KCNH2 (0.69) | MPOCYP3A4KCNH2MEN1KMT2A | |
| SCHEMBL19380918 | 0.82 | MPO (0.67) | MPOCYP3A4KCNH2MEN1KMT2A | |
| SCHEMBL19359353 | 0.81 | MPO (0.48) | MPOCYP3A4MEN1KMT2A | |
| SCHEMBL30433738 | 0.80 | MEN1 (0.57) | MPOCYP3A4KCNH2MEN1KMT2A | |
| SCHEMBL19359428 | 0.77 | SLC6A2 (0.58) | MPOCYP3A4BACE1SMN1; SMN2 | |
| SCHEMBL19359334 | 0.77 | MPO (0.69) | MPOCYP3A4MEN1KMT2A | |
| SCHEMBL19359166 | 0.76 | MPO (0.46) | MPOCYP3A4KCNH2MEN1KMT2A | |
| SCHEMBL19359259 | 0.73 | EPHX2 (0.73) | MEN1KMT2ACNR1SMN1; SMN2 | |
| SCHEMBL19359442 | 0.73 | LMNA (0.51) | TDP1TP53SMN1; SMN2 |
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 |