Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.48 |
| ▸ | MAOA | P21397 | 2/20 | 0.44 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | MAOB | P27338 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 3/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.38 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.36 |
| ▸ | PPARD | Q03181 | 2/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.34 |
| ▸ | CASP3 | P42574 | 1/20 | 0.34 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.34 |
| ▸ | RELA | Q04206 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL5546176 | 0.78 | SMN1; SMN2 (0.46) | SMN1; SMN2MAOAHSP90AA1KCNH2MAOB | |
| SCHEMBL2558169 | 0.77 | MAOA (0.39) | SMN1; SMN2MAOAMAOBMEN1KMT2A | |
| SCHEMBL6806413 | 0.77 | HDAC3 (0.47) | SMN1; SMN2MAOAMAOBMEN1KMT2A | |
| SCHEMBL10424504 | 0.77 | ALDH1A1 (0.52) | KMT2AL3MBTL1ALDH1A1MAPTCYP2A6 | |
| SCHEMBL2554286 | 0.77 | ALDH1A1 (0.43) | SMN1; SMN2MEN1KMT2ANPC1RAB9A | |
| SCHEMBL8746031 | 0.77 | CA2 (0.48) | HSP90AA1KCNH2MAOBMEN1KMT2A | |
| SCHEMBL8161044 | 0.77 | SMN1; SMN2 (0.44) | SMN1; SMN2MAOAHSP90AA1KCNH2MAOB | |
| SCHEMBL946878 | 0.76 | ALDH1A1 (0.52) | SMN1; SMN2MAOAMAOBNPC1RAB9A | |
| SCHEMBL9171909 | 0.74 | ALDH1A1 (0.50) | SMN1; SMN2MAOAMAOBNPC1RAB9A | |
| SCHEMBL11549917 | 0.73 | MEN1 (0.44) | MEN1KMT2AALDH1A1POLBMAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-2059503-B1 | AMINOPYRAZOLE DERIVATIVES, PROCESS FOR THE PREPARATION THEREOF, AND COMPOSITION FOR PREVENTING OR TREATING ISCHEMIC DISEASES CONTAINING THE SAME | KOREA RES INST CHEM TECH (KR) | 2015-08-26 | — | — | EP | disclosed |