Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.46 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.46 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.46 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.46 |
| ▸ | CHRNG | P07510 | 1/20 | 0.46 |
| ▸ | ITGA5 | P08648 | 1/20 | 0.46 |
| ▸ | CHRNB1 | P11230 | 1/20 | 0.46 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.46 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.46 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.46 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.46 |
| ▸ | CHRND | Q07001 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | CRHBP | P24387 | 1/20 | 0.39 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.37 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL4280120 | 0.91 | LMNA (0.40) | SLC6A3SLC6A2SLC6A4CHRNA1CHRNG | |
| SCHEMBL4291624 | 0.90 | HCRTR2 (0.42) | NPSR1KDM1A | |
| SCHEMBL4288939 | 0.87 | TSHR (0.44) | SLC6A3SLC6A2SLC6A4CHRNA1CHRNG | |
| SCHEMBL4285494 | 0.84 | SLC6A3 (0.43) | SLC6A3SLC6A2SLC6A4KMT2A | |
| SCHEMBL4285849 | 0.83 | SLC6A4 (0.47) | SLC6A3SLC6A2SLC6A4CHRNA1CHRNG | |
| SCHEMBL4292811 | 0.81 | SLC6A4 (0.51) | SLC6A3SLC6A2SLC6A4 | |
| SCHEMBL4291881 | 0.80 | SLC6A3 (0.40) | SLC6A3SLC6A2SLC6A4CHRNA1CHRNG | |
| SCHEMBL4282256 | 0.80 | HCRTR2 (0.43) | LMNANPSR1CHRM3RIPK1KDM4E | |
| SCHEMBL4282512 | 0.79 | HCRTR2 (0.47) | SLC6A3SLC6A2SLC6A4ALDH1A1HTT | |
| SCHEMBL4294072 | 0.76 | CHRNB4 (0.41) | CHRNB4CHRNA3ALDH1A1KMT2ASMN1; SMN2 |
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 |