Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB3 | P13945 | 1/20 | 0.39 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.39 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.39 |
| ▸ | F2 | P00734 | 1/20 | 0.35 |
| ▸ | F10 | P00742 | 1/20 | 0.35 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | XIAP | P98170 | 1/20 | 0.32 |
| ▸ | BIRC3 | Q13489 | 1/20 | 0.32 |
| ▸ | BIRC2 | Q13490 | 1/20 | 0.32 |
| ▸ | RAMP1 | O60894 | 3/20 | 0.31 |
| ▸ | CALCRL | Q16602 | 3/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.31 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.31 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | FPR2 | P25090 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL1645865 | 0.92 | ADRB3 (0.42) | ADRB3ADRA2BADRA2CF2F10 | |
| SCHEMBL3790347 | 0.92 | ADRB3 (0.42) | ADRB3ADRA2BADRA2CF2F10 | |
| SCHEMBL1645860 | 0.92 | ADRB3 (0.42) | ADRB3ADRA2BADRA2CF2F10 | |
| SCHEMBL8378473 | 0.92 | ADRB3 (0.42) | ADRB3ADRA2BADRA2CF2F10 | |
| SCHEMBL1645862 | 0.92 | ADRB3 (0.42) | ADRB3ADRA2BADRA2CF2F10 | |
| SCHEMBL13059226 | 0.92 | ADRB3 (0.42) | ADRB3ADRA2BADRA2CF2F10 | |
| SCHEMBL7999967 | 0.92 | ADRB3 (0.42) | ADRB3ADRA2BADRA2CF2F10 | |
| SCHEMBL8237408 | 0.92 | ADRB3 (0.42) | ADRB3ADRA2BADRA2CF2F10 | |
| SCHEMBL8005984 | 0.92 | ADRB3 (0.36) | ADRB3ADRA2BADRA2CF2F10 | |
| SCHEMBL1683122 | 0.92 | ADRB3 (0.36) | ADRB3ADRA2BADRA2CF2F10 |
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-2010048468-A1 | DEUTERATED MACROCYCLIC INHIBITORS OF VIRAL NS3 PROTEASE | CONCERT PHARMACEUTICALS, INC. (US) | 2010-04-29 | — | — | WO | disclosed |