Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 5/20 | 0.49 |
| ▸ | CTSK | P43235 | 3/20 | 0.49 |
| ▸ | CTSL | P07711 | 2/20 | 0.49 |
| ▸ | CTSB | P07858 | 2/20 | 0.49 |
| ▸ | PSEN1 | P49768 | 4/20 | 0.48 |
| ▸ | PSEN2 | P49810 | 4/20 | 0.48 |
| ▸ | APH1B | Q8WW43 | 4/20 | 0.48 |
| ▸ | NCSTN | Q92542 | 4/20 | 0.48 |
| ▸ | APH1A | Q96BI3 | 4/20 | 0.48 |
| ▸ | PSENEN | Q9NZ42 | 4/20 | 0.48 |
| ▸ | PPARA | Q07869 | 2/20 | 0.48 |
| ▸ | PPARG | P37231 | 1/20 | 0.48 |
| ▸ | ACE | P12821 | 1/20 | 0.47 |
| ▸ | AKT1 | P31749 | 2/20 | 0.47 |
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL555765 | 0.89 | CTSS (0.50) | CTSSCTSKCTSLCTSBPPARA | |
| SCHEMBL1764798 | 0.84 | CTSS (0.64) | CTSSCTSKCTSLCTSBPPARA | |
| SCHEMBL6162474 | 0.84 | CTSS (0.64) | CTSSCTSKCTSLCTSBPPARA | |
| SCHEMBL1021956 | 0.83 | CTSS (0.55) | CTSSCTSKCTSLCTSBPSEN1 | |
| SCHEMBL14085940 | 0.81 | CTSS (0.52) | CTSSCTSKCTSLCTSBPSEN1 | |
| SCHEMBL6163542 | 0.81 | CTSK (0.65) | CTSSCTSKCTSLCTSBPPARA | |
| SCHEMBL6163545 | 0.81 | CTSK (0.65) | CTSSCTSKCTSLCTSBPPARA | |
| SCHEMBL15071347 | 0.80 | CTSS (0.50) | CTSSCTSKCTSLCTSBPSEN1 | |
| SCHEMBL14496976 | 0.79 | SYK (0.60) | CTSSCTSKCTSLCTSBPPARA | |
| SCHEMBL29866102 | 0.79 | PPARA (0.57) | CTSSCTSKCTSLCTSBPPARA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8772277-B2 | Nitrogen-containing heterocyclic compound | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2014-07-08 | — | — | US | disclosed |
| WO-2013018929-A1 | NITROGEN-CONTAINING HETEROCYCLIC COMPOUND | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2013-02-07 | — | — | WO | disclosed |