Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 5/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | TP53 | P04637 | 2/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL13133088 | 0.92 | TSHR (0.40) | TSHRALDH1A1TP53HIF1AHSD17B10 | |
| SCHEMBL13133085 | 0.92 | TSHR (0.40) | TSHRALDH1A1TP53HIF1AHSD17B10 | |
| SCHEMBL13133071 | 0.85 | TSHR (0.46) | TSHRALDH1A1HCAR2 | |
| SCHEMBL18625527 | 0.82 | TSHR (0.41) | TSHRHCAR2 | |
| SCHEMBL13058089 | 0.78 | HSD17B10 (0.47) | TSHRALDH1A1HSD17B10MEN1KMT2A | |
| SCHEMBL18625581 | 0.78 | ALDH1A1 (0.50) | TSHRALDH1A1HSD17B10HCAR2 | |
| SCHEMBL11371758 | 0.78 | TDP1 (0.39) | TSHRALDH1A1TP53HIF1AHSD17B10 | |
| SCHEMBL19177261 | 0.78 | TSHR (0.31) | TSHR | |
| SCHEMBL18300760 | 0.78 | TSHR (0.41) | TSHRHCAR2 | |
| SCHEMBL22129561 | 0.78 | ALDH1A1 (0.48) | TSHRALDH1A1TP53HIF1AHSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105646637-A | Abiraterone derivative, preparation method and medical applications thereof | 四川海思科制药有限公司 | 2016-06-08 | — | — | CN | disclosed |