Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.59 |
| ▸ | MGLL | Q99685 | 6/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | ELANE | P08246 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| Benzylamine SCHEMBL28872943 | 0.83 | ALDH1A1 (0.66) | ALDH1A1MGLLTDP1 | |
| Biphenyl SCHEMBL28529224 | 0.82 | ALDH1A1 (0.73) | ALDH1A1MGLLTDP1 | |
| Benzene SCHEMBL7777595 | 0.82 | ALDH1A1 (0.89) | ALDH1A1MGLL | |
| Benzene SCHEMBL28134170 | 0.82 | ALDH1A1 (0.89) | ALDH1A1MGLL | |
| SCHEMBL7774852 | 0.81 | ALDH1A1 (0.68) | ALDH1A1MGLL | |
| Phenol SCHEMBL727251 | 0.81 | ALDH1A1 (0.71) | ALDH1A1MGLLTDP1 | |
| Toluene SCHEMBL8175017 | 0.81 | ALDH1A1 (0.71) | ALDH1A1MGLLTDP1 | |
| SCHEMBL28838536 | 0.81 | ALDH1A1 (0.71) | ALDH1A1MGLL | |
| O-Xylene SCHEMBL27077638 | 0.81 | ALDH1A1 (0.76) | ALDH1A1MGLL | |
| Glycine SCHEMBL7933211 | 0.80 | ALDH1A1 (0.81) | ALDH1A1MGLL |
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-3171849-A1 | PROTEIN-REPELLENT DENTAL MATERIALS AND USE THEREOF IN DENTAL APPLICATIONS | The University of Maryland, Baltimore (US) | 2017-05-31 | — | — | EP | claimed |
| WO-2016015005-A1 | PROTEIN-REPELLENT DENTAL MATERIALS AND USE THEREOF IN DENTAL APPLICATIONS | UNIVERSITY OF MARYLAND, BALTIMORE (US) | 2016-01-28 | — | — | WO | claimed |