Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX12 | P18054 | 4/20 | 0.74 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.74 |
| ▸ | HPGD | P15428 | 2/20 | 0.74 |
| ▸ | GAA | P10253 | 3/20 | 0.71 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.71 |
| ▸ | POLB | P06746 | 3/20 | 0.71 |
| ▸ | MAPT | P10636 | 2/20 | 0.71 |
| ▸ | MEN1 | O00255 | 2/20 | 0.71 |
| ▸ | LMNA | P02545 | 1/20 | 0.65 |
| ▸ | PKM | P14618 | 1/20 | 0.65 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.64 |
| ▸ | ALPL | P05186 | 1/20 | 0.64 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.61 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.61 |
| ▸ | RAB9A | P51151 | 2/20 | 0.58 |
| ▸ | NPC1 | O15118 | 1/20 | 0.58 |
| ▸ | MAOA | P21397 | 1/20 | 0.58 |
| ▸ | MAOB | P27338 | 1/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL11234863 | 0.86 | ALOX12 (0.65) | ALOX12ALDH1A1HPGDGAAKMT2A | |
| SCHEMBL17956769 | 0.86 | ALOX12 (0.65) | ALOX12ALDH1A1HPGDGAAKMT2A | |
| SCHEMBL1275902 | 0.86 | ALOX12 (1.00) | ALOX12ALDH1A1HPGDGAAKMT2A | |
| SCHEMBL25184062 | 0.85 | ALOX12 (0.61) | ALOX12ALDH1A1HPGDGAAKMT2A | |
| SCHEMBL13360297 | 0.85 | POLB (0.57) | ALOX12ALDH1A1HPGDGAAKMT2A | |
| SCHEMBL11239091 | 0.85 | ALOX12 (0.86) | ALOX12ALDH1A1HPGDGAAKMT2A | |
| SCHEMBL22099652 | 0.84 | KMT2A (0.54) | ALOX12ALDH1A1HPGDGAAKMT2A | |
| SCHEMBL5878389 | 0.83 | ALOX12 (0.77) | ALOX12ALDH1A1HPGDGAAKMT2A | |
| SCHEMBL8388698 | 0.82 | CA9 (0.55) | ALOX12ALDH1A1HPGDGAAPOLB | |
| SCHEMBL21171916 | 0.82 | ALOX12 (0.62) | ALOX12ALDH1A1HPGDGAAKMT2A |
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-2016167511-A2 | N2-(2-METHOXYPHENYL)PYRIMIDINE DERIVATIVE, METHOD FOR PREPARING SAME, AND PHARMACEUTICAL COMPOSITION FOR CANCER PREVENTION OR TREATMENT CONTAINING SAME AS ACTIVE INGREDIENT | 한국화학연구원 | 2016-10-20 | — | — | WO | disclosed |