Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NTSR1 | P30989 | 1/20 | 0.49 |
| ▸ | CTSK | P43235 | 5/20 | 0.48 |
| ▸ | CTSS | P25774 | 5/20 | 0.48 |
| ▸ | CTSL | P07711 | 5/20 | 0.48 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.46 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.46 |
| ▸ | MKNK1 | Q9BUB5 | 4/20 | 0.44 |
| ▸ | MKNK2 | Q9HBH9 | 4/20 | 0.44 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.42 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.42 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.41 |
| ▸ | GPR88 | Q9GZN0 | 1/20 | 0.40 |
| ▸ | CTSB | P07858 | 3/20 | 0.40 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.39 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7424096 | 1.00 | NTSR1 (0.49) | NTSR1CTSKCTSSCTSLAKR1C3 | |
| SCHEMBL7420389 | 0.88 | CTSS (0.48) | CTSKCTSSCTSLAKR1C3AKR1C2 | |
| SCHEMBL7427413 | 0.88 | CTSS (0.48) | CTSKCTSSCTSLAKR1C3AKR1C2 | |
| SCHEMBL7424801 | 0.83 | CTSS (0.46) | CTSKCTSSCTSLAKR1C3AKR1C2 | |
| SCHEMBL7421360 | 0.82 | GPR132 (0.53) | — | |
| SCHEMBL7425607 | 0.82 | CTSL (0.48) | CTSKCTSSCTSLCTSB | |
| SCHEMBL7378949 | 0.81 | MME (0.50) | CTSKCTSS | |
| SCHEMBL7424498 | 0.81 | CTSK (0.49) | CTSKCTSSCTSLCTSBDGAT1 | |
| SCHEMBL7418370 | 0.79 | PSEN1 (0.60) | CTSKCTSSCTSLAKR1C3AKR1C2 | |
| SCHEMBL7419482 | 0.79 | GRN (0.49) | CTSKCTSS |
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 |
|---|---|---|---|---|---|---|---|
| WO-2002039997-A2 | ACE-2 MODULATING COMPOUNDS AND USE THEREOF | MILLENNIUM PHARMACEUTICALS, INC. (US) | 2002-05-23 | — | — | WO | claimed |
| WO-2002039997-A2 | ACE-2 MODULATING COMPOUNDS AND USE THEREOF | MILLENNIUM PHARMACEUTICALS, INC. (US) | 2002-05-23 | — | — | WO | disclosed |