Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 5/20 | 0.43 |
| ▸ | RAB9A | P51151 | 5/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | F2 | P00734 | 3/20 | 0.41 |
| ▸ | GFER | P55789 | 1/20 | 0.39 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.39 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.39 |
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.39 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | CASP3 | P42574 | 1/20 | 0.37 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.37 |
| ▸ | SENP7 | Q9BQF6 | 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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL5211180 | 0.95 | NPC1 (0.39) | NPC1RAB9ASMN1; SMN2HPGDL3MBTL1 | |
| SCHEMBL6996710 | 0.94 | NPC1 (0.43) | NPC1RAB9ASMN1; SMN2HPGDL3MBTL1 | |
| SCHEMBL7432548 | 0.90 | TP53 (0.41) | NPC1RAB9ASMN1; SMN2HPGDF2 | |
| SCHEMBL5208572 | 0.90 | F2 (0.40) | NPC1RAB9ASMN1; SMN2HPGDL3MBTL1 | |
| SCHEMBL5208349 | 0.90 | F2 (0.40) | NPC1F2MAPTADRA2CCYP3A4 | |
| SCHEMBL4807538 | 0.86 | RAB9A (0.40) | NPC1RAB9ASMN1; SMN2HPGDL3MBTL1 | |
| Trifluoroacetic Acid SCHEMBL5209105 | 0.86 | TP53 (0.38) | NPC1RAB9ASMN1; SMN2HPGDF2 | |
| Trifluoroacetic Acid SCHEMBL5210737 | 0.84 | F2 (0.38) | F2MAPTADRA2CPKM | |
| SCHEMBL6993286 | 0.84 | NPC1 (0.37) | NPC1RAB9ASMN1; SMN2HPGDL3MBTL1 | |
| Trifluoroacetic Acid SCHEMBL5208897 | 0.84 | F2 (0.37) | NPC1RAB9ASMN1; SMN2HPGDL3MBTL1 |
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-1343561-B1 | SERINE PROTEASE INHIBITORS | TULARIK LTD (GB) | 2007-02-28 | — | — | EP | disclosed |