Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | MMP9 | P14780 | 1/20 | 0.47 |
| ▸ | MMP8 | P22894 | 1/20 | 0.47 |
| ▸ | MMP14 | P50281 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | CPA3 | P15088 | 3/20 | 0.44 |
| ▸ | CPA1 | P15085 | 2/20 | 0.44 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.44 |
| ▸ | CPB1 | P15086 | 1/20 | 0.44 |
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.44 |
| ▸ | LTA4H | P09960 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | MME | P08473 | 3/20 | 0.42 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.41 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.41 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.41 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL252900 | 0.82 | CYP1A2 (0.68) | CYP1A2CPA3CPA1FOLH1CPB1 | |
| SCHEMBL9007628 | 0.82 | CYP1A2 (0.68) | CYP1A2CPA3CPA1FOLH1CPB1 | |
| SCHEMBL629350 | 0.82 | CYP1A2 (0.68) | CYP1A2CPA3CPA1FOLH1CPB1 | |
| SCHEMBL435251 | 0.79 | CYP1A2 (0.50) | CYP1A2CYP2C19 | |
| SCHEMBL2361534 | 0.79 | CYP1A2 (0.53) | CYP1A2HPGDCPA3CPA1FOLH1 | |
| SCHEMBL11324047 | 0.79 | CYP1A2 (0.53) | CYP1A2CPA3CPA1FOLH1CPB1 | |
| SCHEMBL8144720 | 0.79 | CYP1A2 (0.53) | CYP1A2CPA3CPA1FOLH1CPB1 | |
| SCHEMBL2065619 | 0.79 | CYP1A2 (0.53) | CYP1A2CPA3CPA1FOLH1CPB1 | |
| SCHEMBL16706484 | 0.78 | CYP1A2 (0.52) | CYP1A2MMP9MMP8MMP14HPGD | |
| SCHEMBL28340308 | 0.76 | FAAH (0.47) | CYP1A2MMP9MMP8MMP14HPGD |
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-5569762-A | Asymmetric synthesis of intermediates for retroviral protease inhibitor compounds | AMERICAN CYANAMID COMPANY (US) | 1996-10-29 | — | — | US | disclosed |
| US-5428167-A | Asymmetric synthesis of intermediates for retroviral protease inhibitor compounds | AMERICAN CYANAMID COMPANY (US) | 1995-06-27 | — | — | US | disclosed |