Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.60 |
| ▸ | MEN1 | O00255 | 1/20 | 0.60 |
| ▸ | POLB | P06746 | 1/20 | 0.60 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.60 |
| ▸ | LMNA | P02545 | 1/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.56 |
| ▸ | RAB9A | P51151 | 4/20 | 0.54 |
| ▸ | NPC1 | O15118 | 3/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.54 |
| ▸ | TP53 | P04637 | 2/20 | 0.54 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.54 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL28299730 | 0.85 | — | — | |
| SCHEMBL28299731 | 0.85 | MEN1 (0.61) | ALDH1A1MEN1POLBKMT2ALMNA | |
| SCHEMBL28298329 | 0.84 | NPC1 (0.51) | POLBRAB9ANPC1SMN1; SMN2TP53 | |
| SCHEMBL28299759 | 0.83 | MEN1 (0.59) | ALDH1A1MEN1POLBKMT2ALMNA | |
| SCHEMBL28873606 | 0.82 | GRM4 (0.60) | RAB9ANPC1SMN1; SMN2 | |
| SCHEMBL28299727 | 0.80 | ALDH1A1 (0.69) | ALDH1A1MEN1POLBKMT2ALMNA | |
| SCHEMBL28299723 | 0.79 | RAB9A (0.65) | ALDH1A1MEN1POLBKMT2ALMNA | |
| SCHEMBL28873490 | 0.77 | ALDH1A1 (0.59) | ALDH1A1MEN1POLBKMT2ALMNA | |
| SCHEMBL2868244 | 0.74 | ALDH1A1 (0.59) | ALDH1A1MEN1POLBKMT2ALMNA | |
| SCHEMBL14096253 | 0.73 | ALDH1A1 (0.58) | ALDH1A1MEN1POLBKMT2ALMNA |
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 |