Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | UGCG | Q16739 | 2/20 | 0.46 |
| ▸ | OPRK1 | P41145 | 7/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | MITF | O75030 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | GFER | P55789 | 1/20 | 0.38 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7356874 | 0.86 | UGCG (0.40) | UGCGOPRK1CYP2D6CYP3A4CYP2C19 | |
| SCHEMBL7356051 | 0.84 | UGCG (0.39) | UGCGOPRK1CYP2D6CYP3A4CYP2C19 | |
| SCHEMBL7360512 | 0.78 | L3MBTL1 (0.35) | UGCGKMT2AALDH1A1MEN1 | |
| SCHEMBL8509043 | 0.71 | UGCG (0.51) | UGCGCYP2D6CYP3A4CYP2C19KMT2A | |
| SCHEMBL7355176 | 0.71 | ICMT (0.44) | OPRK1CYP3A4KMT2ARAB9AALDH1A1 | |
| SCHEMBL7353864 | 0.69 | CSNK1E (0.48) | — | |
| SCHEMBL7351833 | 0.68 | MMP2 (0.58) | — | |
| SCHEMBL12702271 | 0.67 | CHRM3 (0.52) | UGCGTSHRSMN1; SMN2ALDH1A1CHRM3 | |
| SCHEMBL7359568 | 0.67 | CSNK1E (0.43) | CYP2C19CYP2C9 | |
| SCHEMBL7642789 | 0.66 | EPHX1 (0.53) | RAB9ASMN1; SMN2ALDH1A1POLBLMNA |
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-1009736-A1 | MALONIC ACID BASED MATRIX METALLOPROTEINASE INHIBITORS | Roche Diagnostics GmbH (DE) | 2000-06-21 | — | — | EP | disclosed |
| WO-1999011608-A1 | MALONIC ACID BASED MATRIX METALLOPROTEINASE INHIBITORS | ROCHE DIAGNOSTICS GMBH (DE) | 1999-03-11 | — | — | WO | disclosed |