Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 7/20 | 0.42 |
| ▸ | RAB9A | P51151 | 6/20 | 0.42 |
| ▸ | PKM | P14618 | 5/20 | 0.42 |
| ▸ | NPC1 | O15118 | 5/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 3/20 | 0.39 |
| ▸ | NAMPT | P43490 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 3/20 | 0.39 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.39 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.39 |
| ▸ | RELA | Q04206 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL5233576 | 0.87 | SMN1; SMN2 (0.56) | SMN1; SMN2RAB9APKMNPC1MAPT | |
| SCHEMBL5236274 | 0.77 | GAA (0.44) | SMN1; SMN2RAB9ATSHRTP53NFKB1 | |
| SCHEMBL5237534 | 0.75 | SMN1; SMN2 (0.58) | SMN1; SMN2RAB9APKMNPC1ALDH1A1 | |
| SCHEMBL5239968 | 0.74 | NAMPT (0.49) | SMN1; SMN2RAB9APKMNPC1MAPT | |
| SCHEMBL5233850 | 0.72 | RAB9A (0.43) | SMN1; SMN2RAB9ATSHRTP53NFKB1 | |
| SCHEMBL5232050 | 0.69 | RAB9A (0.71) | SMN1; SMN2RAB9ANPC1ALDH1A1HPGD | |
| SCHEMBL1164338 | 0.67 | — | — | |
| Toluene SCHEMBL27348422 | 0.67 | PTK2 (0.53) | SMN1; SMN2RAB9AMAPTTSHRTP53 | |
| SCHEMBL5232744 | 0.67 | RAB9A (0.50) | SMN1; SMN2RAB9APKMNPC1MAPT | |
| SCHEMBL5235375 | 0.67 | RAB9A (0.50) | SMN1; SMN2RAB9APKMNPC1MAPT |
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-0811008-B1 | BICYCLIC BENZAZEPINE DERIVATIVES AS VASOPRESSIN ANTAGONISTS | WYETH CORP (US) | 2003-10-01 | — | — | EP | disclosed |