Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | XIAP | P98170 | 7/20 | 0.34 |
| ▸ | F2R | P25116 | 2/20 | 0.32 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.32 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.32 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.32 |
| ▸ | UBE2M | P61081 | 1/20 | 0.32 |
| ▸ | DCUN1D1 | Q96GG9 | 1/20 | 0.32 |
| ▸ | ACE | P12821 | 2/20 | 0.32 |
| ▸ | BIRC3 | Q13489 | 2/20 | 0.31 |
| ▸ | BIRC2 | Q13490 | 2/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | RORC | P51449 | 1/20 | 0.30 |
| ▸ | DPP4 | P27487 | 1/20 | 0.30 |
| ▸ | F2 | P00734 | 2/20 | 0.30 |
| ▸ | PRSS1 | P07477 | 2/20 | 0.30 |
| ▸ | PRSS2 | P07478 | 2/20 | 0.30 |
| ▸ | PRSS3 | P35030 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL13071524 | 0.89 | HTR1A (0.36) | ACEDPP4F2PRSS1PRSS2 | |
| SCHEMBL13072094 | 0.88 | USP2 (0.34) | F2RACEF2PRSS1PRSS2 | |
| SCHEMBL13071668 | 0.88 | ACE (0.33) | ACEF2PRSS1PRSS2PRSS3 | |
| SCHEMBL13071393 | 0.88 | DPP4 (0.32) | XIAPF2RUBE2MDCUN1D1DPP4 | |
| SCHEMBL13072090 | 0.88 | HTT (0.38) | ACEF2PRSS1PRSS2PRSS3 | |
| SCHEMBL13071526 | 0.87 | UBE2M (0.35) | XIAPF2RUBE2MDCUN1D1ACE | |
| SCHEMBL13071425 | 0.86 | ACE (0.38) | ACEDPP4F2PRSS1PRSS2 | |
| SCHEMBL13071521 | 0.86 | CFD (0.39) | CYP2C9 | |
| SCHEMBL13072089 | 0.86 | F2R (0.33) | F2RACEDPP4 | |
| SCHEMBL12831783 | 0.83 | F2R (0.34) | XIAPF2RPIK3CDPIK3CAPIK3CG |
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-2009142842-A9 | NOVEL MACROCYCLIC INHIBITORS OF HEPATITIS C VIRUS REPLICATION | INTERMUNE, INC. (US) | 2010-11-25 | — | — | WO | disclosed |
| WO-2009142842-A2 | NOVEL MACROCYCLIC INHIBITORS OF HEPATITIS C VIRUS REPLICATION | INTERMUNE, INC. (US) | 2009-11-26 | — | — | WO | disclosed |