Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.42 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.39 |
| ▸ | CETP | P11597 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.39 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.39 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.39 |
| ▸ | CHRNA10 | Q9GZZ6 | 1/20 | 0.39 |
| ▸ | CHRNA9 | Q9UGM1 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL7540377 | 0.91 | NPC1 (0.37) | TLR9CETPNPC1KDM4EALDH1A1 | |
| SCHEMBL9154004 | 0.87 | CETP (0.43) | TLR9AOC3CETPCHRNB4CHRNA3 | |
| SCHEMBL7545650 | 0.86 | NPC1 (0.51) | TLR9AOC3CETPNPC1KDM4E | |
| SCHEMBL7537586 | 0.81 | NPC1 (0.54) | TLR9NPC1KDM4EALDH1A1TP53 | |
| SCHEMBL7537821 | 0.81 | NPC1 (0.54) | TLR9NPC1KDM4EALDH1A1TP53 | |
| SCHEMBL2121847 | 0.81 | NPC1 (0.54) | TLR9NPC1KDM4EALDH1A1TP53 | |
| SCHEMBL7537404 | 0.80 | NPC1 (0.53) | TLR9NPC1KDM4EALDH1A1TP53 | |
| SCHEMBL7537408 | 0.80 | NPC1 (0.53) | TLR9NPC1KDM4EALDH1A1TP53 | |
| Hydrochloric Acid SCHEMBL7540963 | 0.80 | NPC1 (0.53) | TLR9NPC1KDM4EALDH1A1TP53 | |
| Hydrochloric Acid SCHEMBL7540959 | 0.80 | NPC1 (0.53) | TLR9NPC1KDM4EALDH1A1TP53 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0676960-A4 | — | — | 1995-11-15 | — | — | EP | disclosed |
| EP-0676960-A1 | CYCLOALKYL AMINE BIS-ARYL SQUALENE SYNTHASE INHIBITORS | RHONE-POULENC RORER PHARMACEUTICALS, INC. (US) | 1995-10-18 | — | — | EP | disclosed |
| WO-1994014435-A1 | CYCLOALKYL AMINE BIS-ARYL SQUALENE SYNTHASE INHIBITORS | RHONE-POULENC RORER PHARMACEUTICALS INC. (US) | 1994-07-07 | — | — | WO | disclosed |