Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.61 |
| ▸ | POLB | P06746 | 1/20 | 0.61 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.61 |
| ▸ | LMNA | P02545 | 1/20 | 0.57 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.57 |
| ▸ | BRAF | P15056 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL28299759 | 0.90 | MEN1 (0.59) | MEN1ALDH1A1POLBKMT2ALMNA | |
| SCHEMBL28299760 | 0.85 | ALDH1A1 (0.60) | MEN1ALDH1A1POLBKMT2ALMNA | |
| SCHEMBL28299719 | 0.84 | NPC1 (0.52) | POLB | |
| SCHEMBL28299723 | 0.84 | RAB9A (0.65) | MEN1ALDH1A1POLBKMT2ALMNA | |
| SCHEMBL28298321 | 0.82 | GRM4 (0.63) | — | |
| SCHEMBL28299727 | 0.81 | ALDH1A1 (0.69) | MEN1ALDH1A1POLBKMT2ALMNA | |
| SCHEMBL28873490 | 0.78 | ALDH1A1 (0.59) | MEN1ALDH1A1POLBKMT2ALMNA | |
| SCHEMBL2868244 | 0.76 | ALDH1A1 (0.59) | MEN1ALDH1A1POLBKMT2ALMNA | |
| SCHEMBL6052559 | 0.76 | NPC1 (0.49) | — | |
| SCHEMBL14096253 | 0.76 | ALDH1A1 (0.58) | MEN1ALDH1A1POLBKMT2ALMNA |
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 |
|---|---|---|---|---|---|---|---|
| CN-106674098-B | N- (3- cyano -4- alkoxyl phenyl) pyridine carboxamides and application thereof | 中国医科大学 | 2019-07-02 | — | — | CN | disclosed |