Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 1/20 | 0.46 |
| ▸ | MME | P08473 | 5/20 | 0.44 |
| ▸ | ACE | P12821 | 4/20 | 0.44 |
| ▸ | CPA1 | P15085 | 2/20 | 0.44 |
| ▸ | ACE2 | Q9BYF1 | 2/20 | 0.44 |
| ▸ | FCER2 | P06734 | 2/20 | 0.43 |
| ▸ | MMP9 | P14780 | 2/20 | 0.43 |
| ▸ | MMP8 | P22894 | 2/20 | 0.43 |
| ▸ | CCR1 | P32246 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CTSD | P07339 | 2/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.41 |
| ▸ | HTR2C | P28335 | 1/20 | 0.41 |
| ▸ | HTR2B | P41595 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8918697 | 1.00 | TACR1 (0.46) | TACR1MMEACECPA1ACE2 | |
| SCHEMBL8919979 | 0.85 | MME (0.47) | TACR1MMEACECPA1ACE2 | |
| SCHEMBL6944317 | 0.84 | BACE1 (0.47) | CYP1A2 | |
| SCHEMBL2712694 | 0.84 | BACE1 (0.47) | CYP1A2 | |
| SCHEMBL10707926 | 0.84 | BACE1 (0.47) | CYP1A2 | |
| SCHEMBL2712697 | 0.84 | BACE1 (0.47) | CYP1A2 | |
| SCHEMBL6944939 | 0.84 | BACE1 (0.47) | CYP1A2 | |
| SCHEMBL6944942 | 0.84 | BACE1 (0.47) | CYP1A2 | |
| SCHEMBL8919984 | 0.83 | MME (0.44) | TACR1MMEACECPA1ACE2 | |
| SCHEMBL12805325 | 0.80 | MME (0.51) | TACR1MMEACECPA1ACE2 |
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-5652369-A | PROTEASE INHIBITOR | HOFFMANN-LA ROCHE INC. (US) | 1997-07-29 | — | — | US | disclosed |
| US-5446161-A | Protease inhibitor, viricides | HOFFMANN-LA ROCHE INC. (US) | 1995-08-29 | — | — | US | disclosed |