Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 13/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 1/20 | 0.52 |
| ▸ | HTT | P42858 | 1/20 | 0.52 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.52 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.52 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.50 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.50 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL8791519 | 0.95 | ACHE (0.60) | ACHEALDH1A1LMNAMAPTHTT | |
| Hydrochloric Acid SCHEMBL8790451 | 0.94 | ACHE (0.59) | ACHEALDH1A1LMNAMAPTHTT | |
| Hydrochloric Acid SCHEMBL8789998 | 0.90 | ACHE (0.58) | ACHEALDH1A1LMNAMAPTHTT | |
| SCHEMBL14577865 | 0.90 | ACHE (0.59) | ACHE | |
| Hydrochloric Acid SCHEMBL8791390 | 0.89 | ALDH1A1 (0.59) | ACHEALDH1A1LMNAMAPTHTT | |
| SCHEMBL13987085 | 0.87 | ACHE (0.75) | ACHE | |
| SCHEMBL8791610 | 0.87 | ACHE (0.53) | ACHEALDH1A1LMNAMAPTHTT | |
| Hydrochloric Acid SCHEMBL7237165 | 0.87 | ACHE (0.74) | ACHE | |
| SCHEMBL8790725 | 0.86 | HDAC1 (0.59) | ACHEALDH1A1LMNAMAPTHTT | |
| SCHEMBL4499285 | 0.83 | ACHE (0.56) | ACHE |
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-0560235-B1 | Condensed heterocyclic ketone derivatives, their production and use | TAKEDA CHEMICAL INDUSTRIES LTD (JP) | 1997-06-04 | — | — | EP | claimed |
| US-5462934-A | Cholinesterase inhibitor; learning enhancement | TAKEDA CHEMICAL INDUSTRIES (JP) | 1995-10-31 | — | — | US | claimed |
| EP-0560235-A1 | Condensed heterocyclic ketone derivatives, their production and use | Takeda Chemical Industries, Ltd. (JP) | 1993-09-15 | — | — | EP | claimed |