Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | CFTR | P13569 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.47 |
| ▸ | POLB | P06746 | 2/20 | 0.47 |
| ▸ | ATM | Q13315 | 1/20 | 0.47 |
| ▸ | MYC | P01106 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 2/20 | 0.44 |
| ▸ | CA1 | P00915 | 2/20 | 0.44 |
| ▸ | CA2 | P00918 | 2/20 | 0.44 |
| ▸ | CA9 | Q16790 | 2/20 | 0.44 |
| ▸ | CA12 | O43570 | 1/20 | 0.44 |
| ▸ | CA7 | P43166 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL1707841 | 1.00 | TSHR (0.50) | TSHRLMNANR4A2ALDH1A1CFTR | |
| SCHEMBL987813 | 0.88 | TSHR (0.57) | TSHRLMNAALDH1A1CFTRHSD17B10 | |
| SCHEMBL30928350 | 0.84 | POLB (0.44) | TSHRLMNANR4A2ALDH1A1CFTR | |
| SCHEMBL28097960 | 0.83 | MYC (0.41) | TSHRNR4A2ALDH1A1CFTRHSD17B10 | |
| SCHEMBL6096081 | 0.82 | CA12 (0.44) | TSHRLMNANR4A2ALDH1A1CFTR | |
| SCHEMBL29279663 | 0.82 | TSHR (0.52) | TSHRLMNAALDH1A1CFTRHSD17B10 | |
| SCHEMBL20723038 | 0.81 | TSHR (0.63) | TSHRALDH1A1HSD17B10KDM4EPOLB | |
| SCHEMBL14296805 | 0.81 | LMNA (0.50) | TSHRLMNAALDH1A1CFTRHSD17B10 | |
| SCHEMBL28679016 | 0.81 | TSHR (0.50) | TSHRLMNANR4A2ALDH1A1CFTR | |
| SCHEMBL16960929 | 0.81 | TSHR (0.50) | TSHRLMNAALDH1A1CFTRHSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3911716-B1 | MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES | MERCK PATENT GMBH (DE) | 2022-09-21 | — | — | EP | disclosed |