Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 2/20 | 0.41 |
| ▸ | CHRNA7 | P36544 | 2/20 | 0.41 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | EED | O75530 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | HTR2C | P28335 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL18466133 | 0.87 | CHRNA7 (0.49) | CHRNB2CHRNA7CHRNA4MEN1KMT2A | |
| SCHEMBL1355770 | 0.83 | KCNH2 (0.52) | CHRNB2CHRNA7CHRNA4MEN1KMT2A | |
| SCHEMBL1355768 | 0.83 | KCNH2 (0.52) | CHRNB2CHRNA7CHRNA4MEN1KMT2A | |
| SCHEMBL31494212 | 0.79 | MEN1 (0.61) | CHRNB2CHRNA7CHRNA4MEN1KMT2A | |
| SCHEMBL6178879 | 0.79 | MEN1 (0.61) | CHRNB2CHRNA7CHRNA4MEN1KMT2A | |
| SCHEMBL2808985 | 0.79 | MEN1 (0.61) | CHRNB2CHRNA7CHRNA4MEN1KMT2A | |
| SCHEMBL18616370 | 0.78 | HTR2C (0.62) | EEDSLC6A2SLC6A4HTR2C | |
| SCHEMBL24310072 | 0.77 | KCNH2 (0.57) | KCNH2HTR2CHTR2B | |
| SCHEMBL8504541 | 0.76 | DRD2 (0.49) | CHRNB2CHRNA7CHRNA4MEN1KMT2A | |
| SCHEMBL16409558 | 0.75 | CHRNB2 (0.45) | CHRNB2CHRNA7CHRNA4MEN1KMT2A |
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-2017040449-A1 | TRIAZOLOPYRIDINE INHIBITORS OF MYELOPEROXIDASE | BRISTOL-MYERS SQUIBB COMPANY (US) | 2017-03-09 | — | — | WO | disclosed |