Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 9/20 | 0.47 |
| ▸ | SLC6A3 | Q01959 | 9/20 | 0.47 |
| ▸ | SLC6A2 | P23975 | 6/20 | 0.47 |
| ▸ | CHRNB4 | P30926 | 4/20 | 0.47 |
| ▸ | CHRNA3 | P32297 | 4/20 | 0.47 |
| ▸ | CHRNA1 | P02708 | 3/20 | 0.47 |
| ▸ | CHRNG | P07510 | 3/20 | 0.47 |
| ▸ | ITGA5 | P08648 | 3/20 | 0.47 |
| ▸ | CHRNB1 | P11230 | 3/20 | 0.47 |
| ▸ | CHRNB2 | P17787 | 3/20 | 0.47 |
| ▸ | CHRNA4 | P43681 | 3/20 | 0.47 |
| ▸ | CHRND | Q07001 | 3/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.39 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.39 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.38 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL4288939 | 0.92 | TSHR (0.44) | SLC6A4SLC6A3SLC6A2CHRNB4CHRNA3 | |
| SCHEMBL4292811 | 0.90 | SLC6A4 (0.51) | SLC6A4SLC6A3SLC6A2 | |
| SCHEMBL4280120 | 0.86 | LMNA (0.40) | SLC6A4SLC6A3SLC6A2CHRNB4CHRNA3 | |
| SCHEMBL4291883 | 0.83 | SLC6A3 (0.46) | SLC6A4SLC6A3SLC6A2CHRNB4CHRNA3 | |
| SCHEMBL4294072 | 0.81 | CHRNB4 (0.41) | CHRNB4CHRNA3HCRTR1HCRTR2OPRK1 | |
| SCHEMBL4291624 | 0.81 | HCRTR2 (0.42) | HCRTR2OPRK1 | |
| SCHEMBL4285848 | 0.80 | SLC6A2 (0.42) | SLC6A4SLC6A3SLC6A2CHRNB4CHRNA3 | |
| SCHEMBL4285494 | 0.79 | SLC6A3 (0.43) | SLC6A4SLC6A3SLC6A2 | |
| SCHEMBL4282512 | 0.79 | HCRTR2 (0.47) | SLC6A4SLC6A3SLC6A2TSHRHCRTR2 | |
| SCHEMBL4281409 | 0.77 | ALDH1A1 (0.38) | ITGA5 |
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 |