Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 9/20 | 0.55 |
| ▸ | NPC1 | O15118 | 7/20 | 0.55 |
| ▸ | RAB9A | P51151 | 6/20 | 0.55 |
| ▸ | TP53 | P04637 | 6/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.55 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.55 |
| ▸ | HPGD | P15428 | 4/20 | 0.55 |
| ▸ | MEN1 | O00255 | 1/20 | 0.55 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.55 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.55 |
| ▸ | RELA | Q04206 | 1/20 | 0.55 |
| ▸ | HTR7 | P34969 | 2/20 | 0.52 |
| ▸ | GRM5 | P41594 | 1/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.50 |
| ▸ | TSHR | P16473 | 4/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.48 |
| ▸ | S1PR1 | P21453 | 4/20 | 0.48 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL7958616 | 0.91 | NPC1 (0.67) | SMN1; SMN2NPC1RAB9ATP53ALDH1A1 | |
| SCHEMBL7956779 | 0.89 | HTR7 (0.52) | SMN1; SMN2NPC1RAB9ATP53ALDH1A1 | |
| SCHEMBL5736045 | 0.88 | HTR7 (0.63) | SMN1; SMN2NPC1RAB9ATP53ALDH1A1 | |
| SCHEMBL7947853 | 0.88 | HTR7 (0.51) | SMN1; SMN2NPC1RAB9ATP53ALDH1A1 | |
| SCHEMBL7947522 | 0.88 | HTR7 (0.51) | SMN1; SMN2NPC1RAB9ATP53ALDH1A1 | |
| SCHEMBL7956454 | 0.87 | HTR7 (0.52) | SMN1; SMN2NPC1RAB9ATP53ALDH1A1 | |
| SCHEMBL7954897 | 0.84 | HTR7 (0.56) | SMN1; SMN2NPC1RAB9ATP53ALDH1A1 | |
| SCHEMBL7957222 | 0.84 | HTR7 (0.53) | SMN1; SMN2NPC1RAB9ATP53ALDH1A1 | |
| SCHEMBL7947650 | 0.82 | SMN1; SMN2 (0.52) | SMN1; SMN2NPC1RAB9ATP53ALDH1A1 | |
| SCHEMBL7947658 | 0.82 | SMN1; SMN2 (0.56) | SMN1; SMN2NPC1RAB9ATP53ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6277872-B1 | ANTIISCHEMIC AGENTS; BRAIN DISORDERS | BOEHRINGER INGELHEIM KG (DE) | 2001-08-21 | — | — | US | disclosed |