Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK14 | Q16539 | 15/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | TMEM97 | Q5BJF2 | 2/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.35 |
| ▸ | KCNJ5 | P48544 | 1/20 | 0.34 |
| ▸ | KCNJ3 | P48549 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL3727801 | 0.84 | MAPK14 (0.39) | MAPK14CA2TMEM97SIGMAR1ALDH1A1 | |
| SCHEMBL3727799 | 0.78 | CA2 (0.41) | MAPK14CA2ALDH1A1TP53CYP3A4 | |
| SCHEMBL1888652 | 0.77 | CA2 (0.39) | CA2TMEM97SIGMAR1ALDH1A1TP53 | |
| SCHEMBL3742916 | 0.77 | TSHR (0.47) | MAPK14CA2TMEM97SIGMAR1ALDH1A1 | |
| SCHEMBL6042316 | 0.77 | CA2 (0.41) | MAPK14CA2TMEM97SIGMAR1ALDH1A1 | |
| SCHEMBL6583458 | 0.75 | TMEM97 (0.45) | MAPK14TMEM97SIGMAR1ALDH1A1TP53 | |
| SCHEMBL6583464 | 0.75 | TMEM97 (0.45) | MAPK14TMEM97SIGMAR1ALDH1A1TP53 | |
| SCHEMBL3489599 | 0.75 | CA2 (0.37) | CA2TMEM97SIGMAR1ALDH1A1TP53 | |
| SCHEMBL20356605 | 0.74 | ALDH1A1 (0.46) | MAPK14CA2TMEM97SIGMAR1ALDH1A1 | |
| SCHEMBL20356712 | 0.74 | ALDH1A1 (0.46) | MAPK14CA2TMEM97SIGMAR1ALDH1A1 |
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-2129666-A2 | DEVELOPMENT OF MOLECULAR IMAGING PROBES FOR CARBONIC ANHYDRASE-IX USING CLICK CHEMISTRY | Siemens Medical Solutions USA, Inc. (US) | 2009-12-09 | — | — | EP | disclosed |
| WO-2008124703-A2 | DEVELOPMENT OF MOLECULAR IMAGING PROBES FOR CARBONIC ANHYDRASE-IX USING CLICK CHEMISTRY | SIEMENS MEDICAL SOLUTIONS USA, INC. (US) | 2008-10-16 | — | — | WO | disclosed |