Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | MMP3 | P08254 | 1/20 | 0.48 |
| ▸ | TNKS | O95271 | 1/20 | 0.46 |
| ▸ | MAOA | P21397 | 1/20 | 0.45 |
| ▸ | MAOB | P27338 | 1/20 | 0.45 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.44 |
| ▸ | KIF11 | P52732 | 2/20 | 0.43 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | TDO2 | P48775 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 3/20 | 0.42 |
| ▸ | CA1 | P00915 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.42 |
| ▸ | CA12 | O43570 | 1/20 | 0.42 |
| ▸ | CA3 | P07451 | 1/20 | 0.42 |
| ▸ | CA6 | P23280 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL18322222 | 1.00 | TSHR (0.52) | TSHRMMP3TNKSMAOAMAOB | |
| SCHEMBL23624495 | 0.90 | MAOA (0.50) | TSHRMMP3TNKSMAOAMAOB | |
| SCHEMBL22049794 | 0.90 | ALDH1A1 (0.61) | TSHRMMP3TNKSCYP11B2KIF11 | |
| SCHEMBL23624435 | 0.90 | MAOB (0.50) | TSHRMMP3TNKSMAOAMAOB | |
| SCHEMBL13170996 | 0.88 | TNKS (0.43) | TSHRMMP3TNKSMAOAMAOB | |
| SCHEMBL23624359 | 0.88 | CYP1A2 (0.48) | TSHRMMP3TNKSMAOAMAOB | |
| SCHEMBL20733779 | 0.88 | CYP1A2 (0.48) | TSHRMMP3TNKSCYP11B2KIF11 | |
| SCHEMBL21313428 | 0.88 | TSHR (0.41) | TSHRMMP3TNKSMAOAMAOB | |
| SCHEMBL30708993 | 0.88 | MAOA (0.48) | TSHRMMP3TNKSMAOAMAOB | |
| SCHEMBL29847362 | 0.88 | TSHR (0.41) | TSHRMMP3TNKSMAOAMAOB |
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-116162253-A | Cu (I) -MOF coordination compound SUST-WZ3 for realizing ultra-long near infrared room temperature phosphorescence and preparation method thereof | 陕西科技大学 | 2023-05-26 | — | — | CN | claimed |
| CN-116162253-A | Cu (I) -MOF coordination compound SUST-WZ3 for realizing ultra-long near infrared room temperature phosphorescence and preparation method thereof | 陕西科技大学 | 2023-05-26 | — | — | CN | disclosed |