Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MGLL | Q99685 | 1/20 | 0.35 |
| ▸ | BCHE | P06276 | 2/20 | 0.34 |
| ▸ | ACHE | P22303 | 2/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8552420 | 0.73 | BCHE (0.45) | BCHEACHEHTT | |
| SCHEMBL8549480 | 0.72 | BCHE (0.35) | MGLLBCHEACHECYP2C19SMN1; SMN2 | |
| SCHEMBL8549475 | 0.71 | SMN1; SMN2 (0.65) | CYP2C19SMN1; SMN2HTTNPC1MEN1 | |
| SCHEMBL28710267 | 0.69 | HRH3 (0.46) | ACHEHTTALDH1A1NPC1 | |
| SCHEMBL7255771 | 0.65 | HRH3 (0.39) | ACHEALDH1A1NPC1 | |
| SCHEMBL21836003 | 0.62 | CHRNB2 (0.40) | SMN1; SMN2NPC1 | |
| SCHEMBL23826475 | 0.62 | HTR2C (0.50) | CYP2C19SMN1; SMN2NPC1 | |
| SCHEMBL28856036 | 0.62 | ALDH1A1 (0.44) | CYP2C19SMN1; SMN2HTTALDH1A1MEN1 | |
| SCHEMBL7390923 | 0.62 | SPHK1 (0.54) | CYP2C19SMN1; SMN2NPC1 | |
| SCHEMBL21362306 | 0.61 | SMN1; SMN2 (0.43) | CYP2C19SMN1; SMN2ALDH1A1NPC1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0858457-A1 | 5-MEMBERED HETEROCYCLES, PHARMACEUTICAL AGENTS CONTAINING SAID COMPOUNDS AND THE USE THEREOF AND METHODS OF PRODUCING THEM | Dr. Karl Thomae GmbH (DE) | 1998-08-19 | — | — | EP | disclosed |
| WO-1997015567-A1 | 5-MEMBERED HETEROCYCLES, PHARMACEUTICAL AGENTS CONTAINING SAID COMPOUNDS AND THE USE THEREOF AND METHODS OF PRODUCING THEM | DR. KARL THOMAE GMBH (DE) | 1997-05-01 | — | — | WO | disclosed |