Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.39 |
| ▸ | NPY1R | P25929 | 1/20 | 0.38 |
| ▸ | NPY2R | P49146 | 1/20 | 0.38 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | ADRB2 | P07550 | 3/20 | 0.38 |
| ▸ | ADRB1 | P08588 | 3/20 | 0.38 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.38 |
| ▸ | CYP2J2 | P51589 | 1/20 | 0.38 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.38 |
| ▸ | ADRB3 | P13945 | 2/20 | 0.37 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL17034208 | 0.99 | THRB (0.41) | THRBALDH1A1LMNAABCB1NPY1R | |
| SCHEMBL17034354 | 0.96 | THRB (0.39) | THRBALDH1A1LMNAABCB1NPY1R | |
| SCHEMBL17034209 | 0.95 | THRB (0.40) | THRBALDH1A1ABCB1NPY1RNPY2R | |
| SCHEMBL17034273 | 0.94 | THRB (0.42) | THRBALDH1A1ABCB1NPY1RNPY2R | |
| SCHEMBL17034225 | 0.93 | THRB (0.43) | THRBALDH1A1ABCB1NPY1RNPY2R | |
| SCHEMBL17034223 | 0.88 | THRB (0.53) | THRBALDH1A1HRH3MAPTL3MBTL1 | |
| SCHEMBL17034332 | 0.88 | THRB (0.53) | THRBALDH1A1HRH3MAPTL3MBTL1 | |
| SCHEMBL17036960 | 0.85 | THRB (0.51) | THRBALDH1A1LMNANPY1RNPY2R | |
| SCHEMBL17034346 | 0.85 | THRB (0.50) | THRBALDH1A1LMNAHRH3MAPT | |
| SCHEMBL17034241 | 0.85 | THRB (0.50) | THRBALDH1A1LMNAHRH3MAPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2015126666-A1 | DENTAL COMPOSITION AND USE THEREOF | 3M INNOVATIVE PROPERTIES COMPANY (US) | 2015-08-27 | — | — | WO | disclosed |