Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 2/20 | 0.57 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.57 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.57 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.57 |
| ▸ | JAK1 | P23458 | 1/20 | 0.55 |
| ▸ | TYK2 | P29597 | 1/20 | 0.55 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | TP53 | P04637 | 2/20 | 0.50 |
| ▸ | MAPT | P10636 | 2/20 | 0.50 |
| ▸ | PROKR1 | Q8TCW9 | 8/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL14151217 | 0.87 | HDAC1 (0.46) | SLC6A2SLC6A4SLC6A3KCNH2JAK1 | |
| SCHEMBL14151219 | 0.87 | HDAC1 (0.46) | SLC6A2SLC6A4SLC6A3KCNH2JAK1 | |
| SCHEMBL29790471 | 0.85 | ALDH1A1 (0.56) | SLC6A2SLC6A4SLC6A3KCNH2JAK1 | |
| SCHEMBL24855522 | 0.85 | ALDH1A1 (0.56) | SLC6A2SLC6A4SLC6A3KCNH2JAK1 | |
| SCHEMBL21121506 | 0.81 | MGLL (0.60) | — | |
| SCHEMBL828970 | 0.80 | TP53 (0.52) | SLC6A2SLC6A4SLC6A3KCNH2JAK1 | |
| SCHEMBL14150822 | 0.80 | LRRK2 (0.47) | SLC6A2SLC6A4SLC6A3KCNH2LMNA | |
| SCHEMBL14150823 | 0.80 | LRRK2 (0.47) | SLC6A2SLC6A4SLC6A3KCNH2LMNA | |
| SCHEMBL30022985 | 0.79 | JAK1 (0.59) | SLC6A2SLC6A4SLC6A3KCNH2JAK1 | |
| SCHEMBL3312540 | 0.78 | ALDH1A1 (0.62) | LMNATP53MAPTPROKR1HPGD |
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 |