Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.67 |
| ▸ | LMNA | P02545 | 1/20 | 0.67 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.59 |
| ▸ | GAA | P10253 | 1/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.53 |
| ▸ | OPRM1 | P35372 | 10/20 | 0.52 |
| ▸ | ALPL | P05186 | 1/20 | 0.52 |
| ▸ | SRC | P12931 | 1/20 | 0.51 |
| ▸ | HSP90AB1 | P08238 | 2/20 | 0.50 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.48 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.45 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL6163724 | 0.87 | ALDH1A1 (0.65) | ALDH1A1LMNANPSR1GAAKMT2A | |
| SCHEMBL6770581 | 0.87 | ALDH1A1 (0.62) | ALDH1A1LMNANPSR1GAAKMT2A | |
| SCHEMBL6770491 | 0.86 | OPRM1 (0.51) | ALDH1A1LMNANPSR1GAAKMT2A | |
| SCHEMBL6771820 | 0.82 | OPRM1 (0.75) | OPRM1SRCHSP90AB1OPRD1OPRK1 | |
| SCHEMBL6771081 | 0.82 | ALDH1A1 (0.58) | ALDH1A1LMNANPSR1GAAKMT2A | |
| SCHEMBL6772068 | 0.81 | ALDH1A1 (0.57) | ALDH1A1LMNANPSR1GAAKMT2A | |
| SCHEMBL6771450 | 0.81 | OPRM1 (0.46) | ALDH1A1LMNANPSR1GAAKMT2A | |
| SCHEMBL6767582 | 0.81 | ALDH1A1 (0.56) | ALDH1A1LMNANPSR1GAAKMT2A | |
| SCHEMBL6771042 | 0.80 | ALDH1A1 (0.44) | ALDH1A1LMNANPSR1GAAKMT2A | |
| SCHEMBL6767529 | 0.80 | OPRM1 (0.72) | ALDH1A1LMNAKMT2AOPRM1SRC |
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-6716856-B1 | CELL PROLIFERATIVE DISORDERS OR ALZHEIMER'S DISEASE; REDUCED TOXICITY; CDK/CYCLIN KINASE INHIBITORY ACTIVITY | PHARMACIA & TUBJOHN SPA (IT) | 2004-04-06 | — | — | US | disclosed |