Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATM | Q13315 | 1/20 | 0.50 |
| ▸ | GPR119 | Q8TDV5 | 3/20 | 0.46 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 3/20 | 0.43 |
| ▸ | MEN1 | O00255 | 3/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | ESR1 | P03372 | 1/20 | 0.42 |
| ▸ | CA7 | P43166 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 0.42 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.42 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL14720577 | 0.87 | ATM (0.49) | ATMGPR119ADORA1NPSR1MAPT | |
| SCHEMBL4033844 | 0.81 | ATM (0.48) | ATMGPR119ADORA1NPSR1MAPT | |
| SCHEMBL1742370 | 0.80 | SMN1; SMN2 (0.60) | ATMGPR119NPSR1MAPTMEN1 | |
| SCHEMBL8054238 | 0.79 | NAMPT (0.54) | ATMADORA1MAPTALDH1A1 | |
| SCHEMBL24317392 | 0.78 | MAPK1 (0.57) | ATMMAPTRAB9AMEN1KMT2A | |
| SCHEMBL8040438 | 0.78 | NAMPT (0.54) | ATMGPR119NPSR1MAPTMEN1 | |
| SCHEMBL32660726 | 0.77 | ALDH1A1 (0.70) | ATMNPSR1MAPTRAB9AMEN1 | |
| SCHEMBL2397782 | 0.77 | ADORA1 (0.46) | GPR119ADORA1KMT2ASMN1; SMN2ESR2 | |
| SCHEMBL15961874 | 0.76 | ATM (0.48) | ATMGPR119NPSR1MAPTRAB9A | |
| SCHEMBL1375168 | 0.76 | GPR119 (0.61) | ATMGPR119NPSR1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2013027001-A1 | COMPOUNDS AND THEIR USE TO TREAT HISTAMINE H3 RELATED DISORDERS | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2013-02-28 | — | — | WO | disclosed |