Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 5/20 | 0.50 |
| ▸ | RAB9A | P51151 | 4/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.50 |
| ▸ | HPGD | P15428 | 3/20 | 0.50 |
| ▸ | MEN1 | O00255 | 3/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | MAPT | P10636 | 2/20 | 0.50 |
| ▸ | TP53 | P04637 | 2/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.50 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.50 |
| ▸ | RELA | Q04206 | 1/20 | 0.50 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL7956976 | 0.91 | SMN1; SMN2 (0.54) | NPC1RAB9ASMN1; SMN2KDM4EHPGD | |
| SCHEMBL7958842 | 0.88 | NPC1 (0.56) | NPC1RAB9ASMN1; SMN2KDM4EHPGD | |
| SCHEMBL7956790 | 0.86 | TTR (0.54) | NPC1RAB9ASMN1; SMN2KDM4EHPGD | |
| Irampanel SCHEMBL678128 | 0.86 | HTR7 (0.63) | NPC1RAB9ASMN1; SMN2KDM4EHPGD | |
| SCHEMBL7956775 | 0.86 | SMN1; SMN2 (0.71) | NPC1RAB9ASMN1; SMN2KDM4EMEN1 | |
| SCHEMBL7961527 | 0.86 | SMN1; SMN2 (0.55) | NPC1RAB9ASMN1; SMN2KDM4EHPGD | |
| Irampanel SCHEMBL6879876 | 0.85 | HTR7 (0.62) | NPC1RAB9ASMN1; SMN2KDM4EHPGD | |
| SCHEMBL7958614 | 0.83 | NPC1 (0.50) | NPC1RAB9ASMN1; SMN2KDM4EHPGD | |
| SCHEMBL7954777 | 0.81 | NPC1 (0.53) | NPC1RAB9ASMN1; SMN2KDM4EHPGD | |
| SCHEMBL7947861 | 0.80 | NPC1 (0.56) | NPC1RAB9ASMN1; SMN2KDM4EHPGD |
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 |