Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.34 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.34 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.34 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.34 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.33 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.33 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.33 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | MMP1 | P03956 | 1/20 | 0.33 |
| ▸ | MMP13 | P45452 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL13309235 | 0.83 | KMT2A (0.41) | KMT2ACHRNB2CHRNB4CHRNA3CHRNA7 | |
| SCHEMBL9387437 | 0.80 | CAD (0.38) | KMT2AL3MBTL1KDM4ELMNARAB9A | |
| SCHEMBL9281977 | 0.77 | ALDH1A1 (0.34) | KMT2ANPSR1RAB9A | |
| SCHEMBL9282729 | 0.77 | ALDH1A1 (0.34) | KMT2ANPSR1RAB9A | |
| SCHEMBL23677559 | 0.73 | KMT2A (0.44) | KMT2ACHRNB2CHRNB4CHRNA3CHRNA7 | |
| SCHEMBL16229721 | 0.73 | KMT2A (0.44) | KMT2ACHRNB2CHRNB4CHRNA3CHRNA7 | |
| SCHEMBL20131552 | 0.73 | KMT2A (0.44) | KMT2ACHRNB2CHRNB4CHRNA3CHRNA7 | |
| SCHEMBL16229720 | 0.73 | KMT2A (0.44) | KMT2ACHRNB2CHRNB4CHRNA3CHRNA7 | |
| SCHEMBL10410305 | 0.73 | KMT2A (0.44) | KMT2ACHRNB2CHRNB4CHRNA3CHRNA7 | |
| SCHEMBL29156418 | 0.73 | KMT2A (0.44) | KMT2ACHRNB2CHRNB4CHRNA3CHRNA7 |
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-5380849-A | Process for optically pure decahydroisoqiunolines | MERCK & CO., INC. (US) | 1995-01-10 | — | — | US | disclosed |