Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.54 |
| ▸ | HTT | P42858 | 1/20 | 0.54 |
| ▸ | PFKFB3 | Q16875 | 1/20 | 0.54 |
| ▸ | PGR | P06401 | 1/20 | 0.53 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.51 |
| ▸ | FABP4 | P15090 | 3/20 | 0.51 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.50 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.50 |
| ▸ | TYMS | P04818 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | RORA | P35398 | 1/20 | 0.49 |
| ▸ | RORC | P51449 | 1/20 | 0.49 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.49 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.49 |
| ▸ | TCF4 | P15884 | 1/20 | 0.48 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL15056114 | 0.80 | PFKFB3 (0.76) | TSHRALDH1A1HTTPFKFB3PGR | |
| SCHEMBL9616602 | 0.80 | TSHR (0.61) | TSHRALDH1A1HTTPFKFB3PGR | |
| SCHEMBL9140469 | 0.78 | TSHR (0.55) | TSHRALDH1A1HTTPFKFB3PGR | |
| SCHEMBL8249331 | 0.77 | KDM4E (0.70) | TSHRALDH1A1HTTKDM4EMAPT | |
| SCHEMBL15762086 | 0.75 | TSHR (1.00) | TSHRALDH1A1HTTPFKFB3PGR | |
| SCHEMBL8752480 | 0.75 | PGR (0.74) | TSHRALDH1A1HTTPFKFB3PGR | |
| SCHEMBL812673 | 0.75 | TSHR (0.74) | TSHRALDH1A1HTTPFKFB3PGR | |
| SCHEMBL31110643 | 0.75 | TSHR (0.74) | TSHRALDH1A1HTTPFKFB3PGR | |
| SCHEMBL8276260 | 0.74 | TSHR (0.54) | TSHRALDH1A1HTTPFKFB3PGR | |
| SCHEMBL259694 | 0.73 | MAPT (0.60) | TSHRALDH1A1HTTPFKFB3PGR |
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 |
|---|---|---|---|---|---|---|---|
| CN-113817150-B | Copolyester containing aromatic secondary amine structure and preparation method and application thereof | 四川大学 | 2022-06-21 | — | — | CN | disclosed |
| CN-113817150-A | Copolyester containing aromatic secondary amine structure and preparation method and application thereof | 四川大学 | 2021-12-21 | — | — | CN | disclosed |