Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 4/20 | 0.50 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | APEX1 | P27695 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.30 |
| ▸ | CA2 | P00918 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7797327 | 0.98 | TSHR (0.53) | SMN1; SMN2TSHRTHRBPOLBAPEX1 | |
| SCHEMBL7797303 | 0.98 | TSHR (0.53) | SMN1; SMN2TSHRTHRBPOLBAPEX1 | |
| SCHEMBL7797298 | 0.97 | SMN1; SMN2 (0.51) | SMN1; SMN2TSHRTHRBPOLBAPEX1 | |
| SCHEMBL7797340 | 0.94 | SMN1; SMN2 (0.54) | SMN1; SMN2TSHRTHRBPOLBAPEX1 | |
| SCHEMBL6559175 | 0.85 | THRB (0.53) | SMN1; SMN2TSHRTHRBPOLBAPEX1 | |
| SCHEMBL7791065 | 0.79 | TSHR (0.47) | SMN1; SMN2TSHRTHRBALDH1A1PKM | |
| SCHEMBL7801826 | 0.79 | SMN1; SMN2 (0.42) | SMN1; SMN2TSHRTHRBALDH1A1PKM | |
| SCHEMBL7791073 | 0.79 | NPSR1 (0.56) | TSHRTHRBPOLBAPEX1HTT | |
| SCHEMBL7797293 | 0.78 | NPSR1 (0.55) | TSHRTHRBPOLBAPEX1HTT | |
| SCHEMBL7797332 | 0.78 | NPSR1 (0.55) | TSHRTHRBPOLBAPEX1HTT |
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-1164125-A1 | ADAMANTANE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF | Daicel Chemical Industries, Ltd. (JP) | 2001-12-19 | — | — | EP | disclosed |