Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 15/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 15/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA7 | P43166 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 7/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9104504 | 0.84 | TDP1 (0.39) | SLC6A4SLC6A3TP53TSHRSLC6A2 | |
| SCHEMBL14625009 | 0.82 | SLC6A4 (0.55) | SLC6A4SLC6A3SLC6A2 | |
| SCHEMBL19767370 | 0.77 | SLC6A4 (0.57) | SLC6A4SLC6A3SLC6A2 | |
| SCHEMBL9913605 | 0.76 | TDP1 (0.42) | SLC6A4SLC6A3TP53TSHRSLC6A2 | |
| SCHEMBL14625431 | 0.74 | SLC6A4 (0.50) | SLC6A4SLC6A3SLC6A2 | |
| SCHEMBL9107623 | 0.71 | ALDH1A1 (0.52) | TP53 | |
| SCHEMBL436499 | 0.71 | SLC6A4 (0.46) | SLC6A4SLC6A3TP53TSHRSLC6A2 | |
| SCHEMBL7898806 | 0.70 | SLC6A4 (0.39) | SLC6A4SLC6A3SLC6A2 | |
| SCHEMBL15709394 | 0.69 | HSD11B1 (0.50) | SLC6A4SLC6A3SLC6A2 | |
| SCHEMBL1905906 | 0.69 | SLC6A4 (0.36) | SLC6A4SLC6A3SLC6A2 |
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-2493845-A1 | SUBSTITUTED 3-PHENYLPROPIONIC ACIDS AND THE USE THEREOF | Bayer Pharma Aktiengesellschaft (DE) | 2012-09-05 | — | — | EP | disclosed |
| WO-2011051165-A1 | SUBSTITUTED 3-PHENYLPROPIONIC ACIDS AND THE USE THEREOF | BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) | 2011-05-05 | — | — | WO | disclosed |