Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 16/20 | 0.56 |
| ▸ | S1PR5 | Q9H228 | 8/20 | 0.56 |
| ▸ | GRK5 | P34947 | 1/20 | 0.56 |
| ▸ | CDK8 | P49336 | 1/20 | 0.56 |
| ▸ | PRKX | P51817 | 1/20 | 0.54 |
| ▸ | IKBKE | Q14164 | 1/20 | 0.54 |
| ▸ | PDGFRA | P16234 | 2/20 | 0.53 |
| ▸ | PIM1 | P11309 | 1/20 | 0.53 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.53 |
| ▸ | CDK7 | P50613 | 1/20 | 0.53 |
| ▸ | JAK3 | P52333 | 1/20 | 0.53 |
| ▸ | TNK2 | Q07912 | 1/20 | 0.53 |
| ▸ | POLQ | O75417 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL14779575 | 0.85 | EPHX2 (0.46) | S1PR1S1PR5GRK5CDK8PRKX | |
| SCHEMBL14677458 | 0.81 | NR1H2 (0.41) | S1PR1S1PR5GRK5CDK8POLQ | |
| SCHEMBL14676489 | 0.80 | NR1H2 (0.40) | S1PR1S1PR5PRKXIKBKEPDGFRA | |
| SCHEMBL1873186 | 0.78 | S1PR1 (0.58) | S1PR1S1PR5PRKXIKBKEPDGFRA | |
| SCHEMBL14779622 | 0.78 | NR1H2 (0.39) | S1PR1S1PR5PRKXIKBKEPDGFRA | |
| SCHEMBL14779624 | 0.78 | NR1H2 (0.39) | S1PR1S1PR5PRKXIKBKEPDGFRA | |
| SCHEMBL14676460 | 0.78 | NOTUM (0.43) | POLQ | |
| SCHEMBL14779566 | 0.77 | NR1H2 (0.39) | S1PR1S1PR5PRKXIKBKEPDGFRA | |
| SCHEMBL14779564 | 0.77 | NR1H2 (0.39) | S1PR1S1PR5PRKXIKBKEPDGFRA | |
| SCHEMBL14675279 | 0.77 | KCNT1 (0.46) | PIM1 |
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-2013018929-A1 | NITROGEN-CONTAINING HETEROCYCLIC COMPOUND | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2013-02-07 | — | — | WO | disclosed |