Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.40 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.39 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.37 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL4291623 | 0.86 | HCRTR2 (0.41) | HCRTR2 | |
| SCHEMBL4282511 | 0.86 | HSD17B10 (0.46) | KMT2ASMN1; SMN2HCRTR2MEN1MAPK1 | |
| SCHEMBL4291881 | 0.84 | SLC6A3 (0.40) | HCRTR2ALDH1A1SLC6A3SLC6A2SLC6A4 | |
| SCHEMBL4280118 | 0.84 | HTR2A (0.40) | HRH3HCRTR2SLC9A1 | |
| SCHEMBL4282253 | 0.82 | TACR1 (0.41) | HCRTR2 | |
| SCHEMBL4292808 | 0.81 | SLC6A3 (0.45) | HTTSLC6A3SLC6A2SLC6A4 | |
| SCHEMBL4288935 | 0.80 | TSHR (0.39) | SMN1; SMN2HTTSLC6A3SLC6A2SLC6A4 | |
| SCHEMBL4285848 | 0.79 | SLC6A2 (0.42) | HRH3SMN1; SMN2HCRTR2HTTALDH1A1 | |
| SCHEMBL4294068 | 0.79 | POLB (0.36) | SMN1; SMN2SIGMAR1ALDH1A1 | |
| SCHEMBL4285494 | 0.77 | SLC6A3 (0.43) | KMT2ATHRBALOX12SLC6A3SLC6A2 |
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-2009072643-A1 | NITROGEN-CONTAINING HETEROCYCLIC COMPOUND AND USE THEREOF | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2009-06-11 | — | — | WO | disclosed |