Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.50 |
| ▸ | TP53 | P04637 | 1/20 | 0.50 |
| ▸ | SRD5A2 | P31213 | 2/20 | 0.47 |
| ▸ | FAAH | O00519 | 1/20 | 0.45 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 3/20 | 0.43 |
| ▸ | CA2 | P00918 | 3/20 | 0.43 |
| ▸ | RXRA | P19793 | 2/20 | 0.43 |
| ▸ | RXRB | P28702 | 2/20 | 0.43 |
| ▸ | RXRG | P48443 | 2/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | CA3 | P07451 | 1/20 | 0.43 |
| ▸ | TYR | P14679 | 1/20 | 0.43 |
| ▸ | DRD1 | P21728 | 1/20 | 0.43 |
| ▸ | CA4 | P22748 | 1/20 | 0.43 |
| ▸ | CA6 | P23280 | 1/20 | 0.43 |
| ▸ | CA5A | P35218 | 1/20 | 0.43 |
| ▸ | CA7 | P43166 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL8531480 | 0.98 | TSHR (0.52) | TSHRTP53SRD5A2FAAHEPHX2 | |
| SCHEMBL29894307 | 0.98 | TSHR (0.52) | TSHRTP53SRD5A2FAAHEPHX2 | |
| Hydrochloric Acid SCHEMBL28635324 | 0.96 | TSHR (0.50) | TSHRTP53SRD5A2FAAHEPHX2 | |
| SCHEMBL28728913 | 0.96 | TSHR (0.50) | TSHRTP53SRD5A2FAAHEPHX2 | |
| SCHEMBL28391425 | 0.92 | BCL2L1 (0.53) | TSHRTP53SRD5A2FAAHEPHX2 | |
| SCHEMBL10859570 | 0.89 | CES2 (0.41) | TSHRFAAHEPHX2CA1CA2 | |
| SCHEMBL29167939 | 0.87 | CES2 (0.39) | TP53FAAHEPHX2CA1CA2 | |
| SCHEMBL11222731 | 0.85 | TSHR (0.52) | TSHRTP53SRD5A2FAAHEPHX2 | |
| SCHEMBL219676 | 0.83 | LMNA (0.56) | TSHRTP53ALDH1A1HSD17B10SMN1; SMN2 | |
| SCHEMBL28123902 | 0.81 | LMNA (0.54) | TSHRTP53ALDH1A1HSD17B10SMN1; SMN2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112321618-A | Zinc complex with 2, 5-bis (trifluoromethyl) terephthalic acid as ligand and preparation method thereof | 桂林理工大学 | 2021-02-05 | — | — | CN | claimed |
| CN-112321618-A | Zinc complex with 2, 5-bis (trifluoromethyl) terephthalic acid as ligand and preparation method thereof | 桂林理工大学 | 2021-02-05 | — | — | CN | disclosed |
| CN-112321618-A | Zinc complex with 2, 5-bis (trifluoromethyl) terephthalic acid as ligand and preparation method thereof | 桂林理工大学 | 2021-02-05 | — | — | CN | disclosed |