Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP12 | P39900 | 2/20 | 0.50 |
| ▸ | MME | P08473 | 1/20 | 0.49 |
| ▸ | ANPEP | P15144 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | ACE | P12821 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | ABCC3 | O15438 | 1/20 | 0.42 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.42 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.42 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.42 |
| ▸ | RARG | P13631 | 1/20 | 0.42 |
| ▸ | CNR1 | P21554 | 1/20 | 0.42 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.42 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL6160649 | 1.00 | MMP12 (0.50) | MMP12MMEANPEPLMNAKMT2A | |
| SCHEMBL6165543 | 0.92 | MMP12 (0.53) | MMP12LMNACYP2C9CYP2C19CTSL | |
| SCHEMBL6160300 | 0.84 | TP53 (0.48) | MMP12MMEANPEPKMT2ACTSL | |
| SCHEMBL6163711 | 0.84 | TP53 (0.48) | MMP12MMEANPEPKMT2ACTSL | |
| SCHEMBL6165955 | 0.84 | TP53 (0.48) | MMP12MMEANPEPKMT2ACTSL | |
| SCHEMBL6163974 | 0.82 | MMP12 (0.46) | MMP12LMNAKMT2ACTSLCTSB | |
| SCHEMBL6160891 | 0.81 | PPARG (0.45) | MMP12MMEANPEPLMNACYP2C9 | |
| SCHEMBL6161005 | 0.81 | PPARG (0.45) | MMP12MMEANPEPLMNACYP2C9 | |
| SCHEMBL6161506 | 0.81 | PPARG (0.45) | MMP12MMEANPEPLMNACYP2C9 | |
| SCHEMBL6162656 | 0.80 | MMP12 (0.43) | MMP12MMEANPEPCYP2C9CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0877740-B1 | THIOL DERIVATIVES WITH METALLOPEPTIDASE INHIBITORY ACTIVITY | ZAMBON SPA (IT) | 2005-03-30 | — | — | EP | disclosed |