Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.75 |
| ▸ | IDO1 | P14902 | 1/20 | 0.54 |
| ▸ | AGXT | P21549 | 1/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.50 |
| ▸ | CASP1 | P29466 | 1/20 | 0.50 |
| ▸ | CASP7 | P55210 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | MAOB | P27338 | 2/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | MAOA | P21397 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.48 |
| ▸ | TACR1 | P25103 | 2/20 | 0.47 |
| ▸ | CA1 | P00915 | 4/20 | 0.45 |
| ▸ | CA2 | P00918 | 3/20 | 0.45 |
| ▸ | CA9 | Q16790 | 3/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL22898004 | 0.87 | TSHR (0.62) | TSHRIDO1AGXTSMN1; SMN2POLB | |
| SCHEMBL5311581 | 0.87 | TSHR (1.00) | TSHRIDO1AGXTPOLBKDM4E | |
| SCHEMBL27380 | 0.87 | TSHR (1.00) | TSHRIDO1AGXTPOLBKDM4E | |
| Hydroxyamine SCHEMBL1680424 | 0.84 | TSHR (0.83) | TSHRIDO1AGXTPOLBKDM4E | |
| SCHEMBL10317949 | 0.84 | TSHR (0.94) | TSHRIDO1AGXTPOLBKDM4E | |
| SCHEMBL1009266 | 0.84 | TSHR (0.94) | TSHRIDO1AGXTPOLBKDM4E | |
| Calcium SCHEMBL2864550 | 0.84 | TSHR (0.94) | TSHRIDO1AGXTPOLBKDM4E | |
| SCHEMBL9795394 | 0.84 | TSHR (0.94) | TSHRIDO1AGXTPOLBKDM4E | |
| SCHEMBL9725547 | 0.84 | TSHR (0.94) | TSHRIDO1AGXTPOLBKDM4E | |
| SCHEMBL9491202 | 0.84 | TSHR (0.94) | TSHRIDO1AGXTPOLBKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-0485458-A1 | THIOACYLATING REAGENTS AND INTERMEDIATES, THIOPEPTIDES, AND METHODS FOR PREPARING AND USING SAME. | IAF BIOCHEM INT (CA) | 1992-05-20 | — | — | EP | claimed |
| WO-1991001976-A1 | THIOACYLATING REAGENTS AND INTERMEDIATES, THIOPEPTIDES, AND METHODS FOR PREPARING AND USING SAME | IAF BIOCHEM INTERNATIONAL INC. (CA) | 1991-02-21 | — | — | WO | claimed |