Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSB | P07858 | 1/20 | 0.45 |
| ▸ | CTSS | P25774 | 1/20 | 0.37 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.36 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.36 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | XIAP | P98170 | 2/20 | 0.33 |
| ▸ | BIRC3 | Q13489 | 2/20 | 0.33 |
| ▸ | BIRC2 | Q13490 | 2/20 | 0.33 |
| ▸ | CCKBR | P32239 | 1/20 | 0.32 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.30 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.30 |
| ▸ | RELA | Q04206 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL1646382 | 0.89 | CTSB (0.42) | CTSBCTSSADRB3ADRA2BADRA2C | |
| SCHEMBL3797097 | 0.89 | CTSB (0.42) | CTSBCTSSADRB3ADRA2BADRA2C | |
| SCHEMBL11976287 | 0.89 | CTSB (0.42) | CTSBCTSSADRB3ADRA2BADRA2C | |
| SCHEMBL8000121 | 0.89 | CTSB (0.41) | CTSBCTSSADRB3ADRA2BADRA2C | |
| SCHEMBL13896373 | 0.89 | CTSB (0.41) | CTSBCTSSADRB3ADRA2BADRA2C | |
| SCHEMBL16242467 | 0.89 | CTSB (0.41) | CTSBCTSSADRB3ADRA2BADRA2C | |
| SCHEMBL16242468 | 0.89 | CTSB (0.41) | CTSBCTSSADRB3ADRA2BADRA2C | |
| SCHEMBL16242466 | 0.89 | CTSB (0.41) | CTSBCTSSADRB3ADRA2BADRA2C | |
| SCHEMBL8172111 | 0.88 | CTSB (0.41) | CTSBCTSSADRB3ADRA2BADRA2C | |
| SCHEMBL8202772 | 0.88 | CTSB (0.41) | CTSBCTSSADRB3ADRA2BADRA2C |
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 |
|---|---|---|---|---|---|---|---|
| EP-2177523-A1 | Novel macrocyclic inhibitors of hepatitis c virus replication | Intermune, Inc. (US) | 2010-04-21 | — | — | EP | disclosed |
| WO-2008137779-A2 | NOVEL MACROCYCLIC INHIBITORS OF HEPATITIS C VIRUS REPLICATION | INTERMUNE, INC. (US) | 2008-11-13 | — | — | WO | disclosed |