Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.50 |
| ▸ | TSHR | P16473 | 4/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 2/20 | 0.30 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.30 |
| ▸ | EPHX2 | P34913 | 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 | |
|---|---|---|---|---|
| SCHEMBL3283411 | 0.85 | THRB (0.54) | THRBALDH1A1TSHRHSD17B10TP53 | |
| SCHEMBL388497 | 0.81 | — | — | |
| SCHEMBL5489092 | 0.79 | THRB (0.48) | THRBALDH1A1TSHR | |
| SCHEMBL28771706 | 0.78 | — | — | |
| Hydrochloric Acid SCHEMBL28031350 | 0.78 | ALDH1A1 (0.42) | THRBALDH1A1TSHRHSD17B10LMNA | |
| SCHEMBL28270620 | 0.77 | — | — | |
| SCHEMBL15642200 | 0.76 | ALDH1A1 (0.63) | THRBALDH1A1TSHRSMN1; SMN2HSD17B10 | |
| SCHEMBL13673138 | 0.75 | — | — | |
| SCHEMBL618850 | 0.74 | ALDH1A1 (0.54) | THRBALDH1A1TSHRSMN1; SMN2HSD17B10 | |
| SCHEMBL130079 | 0.73 | THRB (0.68) | THRBALDH1A1TSHRSMN1; SMN2HSD17B10 |
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 |