Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.43 |
| ▸ | LMNA | P02545 | 3/20 | 0.43 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.43 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.43 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.43 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.43 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.43 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.43 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.43 |
| ▸ | HTR1A | P08908 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | TP53 | P04637 | 2/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.38 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.38 |
| ▸ | SERPINE1 | P05121 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL28405457 | 1.00 | TSHR (0.43) | TSHRLMNACHRM2CHRM4CHRM5 | |
| SCHEMBL20919654 | 1.00 | TSHR (0.43) | TSHRLMNACHRM2CHRM4CHRM5 | |
| SCHEMBL17361237 | 1.00 | TSHR (0.43) | TSHRLMNACHRM2CHRM4CHRM5 | |
| SCHEMBL28505904 | 1.00 | TSHR (0.43) | TSHRLMNACHRM2CHRM4CHRM5 | |
| SCHEMBL7601715 | 1.00 | TSHR (0.43) | TSHRLMNACHRM2CHRM4CHRM5 | |
| SCHEMBL18886361 | 1.00 | TSHR (0.43) | TSHRLMNACHRM2CHRM4CHRM5 | |
| SCHEMBL24835739 | 0.89 | TSHR (0.50) | TSHRLMNACHRM2CHRM4CHRM5 | |
| SCHEMBL30552236 | 0.89 | TSHR (0.50) | TSHRLMNACHRM2CHRM4CHRM5 | |
| SCHEMBL31591142 | 0.89 | TSHR (0.50) | TSHRLMNACHRM2CHRM4CHRM5 | |
| SCHEMBL22326325 | 0.89 | LMNA (0.40) | TSHRLMNACHRM2CHRM4CHRM5 |
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-116249554-A | Compounds and their use in the treatment of cancer | 阿斯利康(瑞典)有限公司 | 2023-06-09 | — | — | CN | disclosed |