Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 4/20 | 0.45 |
| ▸ | CA1 | P00915 | 4/20 | 0.45 |
| ▸ | CA9 | Q16790 | 4/20 | 0.45 |
| ▸ | CA2 | P00918 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.39 |
| ▸ | ZDHHC20 | Q5W0Z9 | 2/20 | 0.39 |
| ▸ | ZDHHC2 | Q9UIJ5 | 2/20 | 0.39 |
| ▸ | MGLL | Q99685 | 1/20 | 0.38 |
| ▸ | MMP1 | P03956 | 1/20 | 0.36 |
| ▸ | MMP2 | P08253 | 1/20 | 0.36 |
| ▸ | MMP3 | P08254 | 1/20 | 0.36 |
| ▸ | MMP8 | P22894 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 3/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 3/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL611182 | 0.91 | CA12 (0.41) | CA12CA1CA9CA2ALDH1A1 | |
| SCHEMBL26737018 | 0.84 | CA12 (0.40) | CA12CA1CA9CA2ALDH1A1 | |
| SCHEMBL20021192 | 0.83 | CA12 (0.42) | CA12CA1CA9CA2ALDH1A1 | |
| SCHEMBL24012398 | 0.82 | CA12 (0.41) | CA12CA1CA9CA2ALDH1A1 | |
| SCHEMBL608202 | 0.81 | — | — | |
| SCHEMBL19488653 | 0.80 | ZDHHC20 (0.45) | CA12CA1CA9ALDH1A1ZDHHC20 | |
| SCHEMBL11585047 | 0.78 | ZDHHC20 (0.42) | CA12CA1CA9CA2ALDH1A1 | |
| SCHEMBL4577981 | 0.77 | ZDHHC20 (0.57) | CA12CA1CA9CA2ALDH1A1 | |
| SCHEMBL11221777 | 0.77 | CA12 (0.52) | CA12CA1CA9CA2ALDH1A1 | |
| SCHEMBL610309 | 0.77 | CA12 (0.40) | CA12CA1CA9CA2ALDH1A1 |
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-2019170812-A1 | DENTAL IMPRESSION MATERIAL | DENTSPLY DETREY GMBH (DE) | 2019-09-12 | — | — | WO | disclosed |
| WO-2017198843-A1 | DENTAL COMPOSITION | DENTSPLY DETREY GMBH (DE) | 2017-11-23 | — | — | WO | disclosed |