Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 1/20 | 0.54 |
| ▸ | SLC6A5 | Q9Y345 | 3/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.47 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | RPS6KB1 | P23443 | 3/20 | 0.46 |
| ▸ | AURKA | O14965 | 2/20 | 0.46 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.46 |
| ▸ | NPY1R | P25929 | 1/20 | 0.46 |
| ▸ | NPY2R | P49146 | 1/20 | 0.46 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.44 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.44 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL16701894 | 0.86 | PKM (0.58) | PKMSLC6A5LMNAGAAHPGD | |
| Carbamic Acid SCHEMBL15635796 | 0.81 | HDAC8 (0.60) | PKMGAAHDAC8HDAC6KMT2A | |
| SCHEMBL1004028 | 0.78 | TSHR (0.58) | HPGDKDM4EALDH1A1SIRT2KMT2A | |
| SCHEMBL21773961 | 0.78 | SPHK2 (0.46) | LMNAGAAHPGDL3MBTL1HDAC8 | |
| SCHEMBL30879601 | 0.77 | HIF1A (0.57) | PKMLMNAGAAHPGDL3MBTL1 | |
| SCHEMBL14855220 | 0.77 | ADH1B (0.46) | HPGDKDM4EALDH1A1RPS6KB1AURKA | |
| Bicarbonate SCHEMBL23420914 | 0.77 | HDAC8 (0.64) | PKMGAAHDAC8HDAC6KMT2A | |
| SCHEMBL11881191 | 0.77 | PKM (0.69) | PKMGAAKMT2AMEN1TDP1 | |
| Bicarbonate SCHEMBL11577277 | 0.77 | HDAC8 (0.64) | PKMGAAHDAC8HDAC6KMT2A | |
| SCHEMBL16709791 | 0.77 | PLA2G10 (0.69) | L3MBTL1HDAC8HDAC6ALDH1A1OPRM1 |
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-6927294-B1 | Nitrogen-containing heterocycles | UNIVERSITY OF SOUTHERN CALIFORNIA (US) | 2005-08-09 | — | — | US | disclosed |