Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.51 |
| ▸ | NPC1 | O15118 | 3/20 | 0.51 |
| ▸ | RAB9A | P51151 | 3/20 | 0.51 |
| ▸ | MAPT | P10636 | 2/20 | 0.51 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.51 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.51 |
| ▸ | RELA | Q04206 | 1/20 | 0.51 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.50 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.49 |
| ▸ | NPBWR1 | P48145 | 6/20 | 0.48 |
| ▸ | MCHR1 | Q99705 | 4/20 | 0.48 |
| ▸ | PKM | P14618 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 2/20 | 0.48 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL4300658 | 0.82 | MAPK1 (0.54) | SMN1; SMN2NPC1RAB9AMAPTPKM | |
| SCHEMBL5788758 | 0.80 | HTT (0.48) | SMN1; SMN2NPC1RAB9AMAPTNFKB1 | |
| SCHEMBL2855932 | 0.79 | NPC1 (0.69) | SMN1; SMN2NPC1RAB9AMAPTNFKB1 | |
| SCHEMBL16060701 | 0.78 | XDH (0.45) | NPC1RAB9AMAPK14RPA1 | |
| SCHEMBL12991623 | 0.77 | NPC1 (0.51) | SMN1; SMN2NPC1RAB9AMAPTNFKB1 | |
| SCHEMBL15897901 | 0.76 | SMN1; SMN2 (0.50) | SMN1; SMN2NPC1RAB9AMAPTHTT | |
| SCHEMBL16252260 | 0.75 | UCHL1 (0.54) | MAPTNPBWR1MCHR1ALDH1A1 | |
| SCHEMBL3296237 | 0.75 | PTPN1 (0.79) | SMN1; SMN2NPC1RAB9AMAPTNFKB1 | |
| SCHEMBL10365375 | 0.75 | PTPN1 (0.57) | SMN1; SMN2NPC1RAB9AMAPTNFKB1 | |
| SCHEMBL460952 | 0.74 | MAPK14 (0.54) | MAPK14ALDH1A1KMT2ATP53HIF1A |
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-1988777-B1 | PYRAZOLES FOR THE TREATMENT OF OBESITY AND OTHER CNS DISORDERS | ATHERSYS INC (US) | 2011-09-21 | — | — | EP | disclosed |