Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | ADH1B | P00325 | 1/20 | 0.39 |
| ▸ | ADH1C | P00326 | 1/20 | 0.39 |
| ▸ | ADH1A | P07327 | 1/20 | 0.39 |
| ▸ | ADH7 | P40394 | 1/20 | 0.39 |
| ▸ | EPHX1 | P07099 | 2/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | S1PR2 | O95136 | 5/20 | 0.34 |
| ▸ | S1PR4 | O95977 | 5/20 | 0.34 |
| ▸ | S1PR1 | P21453 | 5/20 | 0.34 |
| ▸ | S1PR3 | Q99500 | 5/20 | 0.34 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.34 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA7 | P43166 | 1/20 | 0.33 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.33 |
| ▸ | DPP4 | P27487 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL20221221 | 0.90 | TSHR (0.46) | TSHRALDH1A1GAAADH1BADH1C | |
| SCHEMBL11766195 | 0.88 | TSHR (0.44) | TSHRALDH1A1GAAADH1BADH1C | |
| SCHEMBL19073626 | 0.84 | PAOX (0.48) | TSHRGAAADH1BADH1CADH1A | |
| SCHEMBL12912097 | 0.82 | — | — | |
| SCHEMBL10045083 | 0.82 | CYP2C19 (0.57) | TSHRALDH1A1GAAMEN1GLA | |
| Hydrochloric Acid SCHEMBL22771816 | 0.80 | TSHR (0.46) | TSHRALDH1A1GAAADH1BADH1C | |
| SCHEMBL10045065 | 0.78 | CYP2C19 (0.59) | TSHRALDH1A1CA12CA2CA7 | |
| SCHEMBL19634471 | 0.78 | TSHR (0.44) | TSHRALDH1A1GAAADH1BADH1C | |
| SCHEMBL12655404 | 0.78 | TSHR (0.44) | TSHRALDH1A1GAAADH1BADH1C | |
| SCHEMBL19582464 | 0.76 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5113000-A | Multifunctional, sealers for semiconductors, improved adhesion | TOSHIBA SILICONE CO., LTD. (JP) | 1992-05-12 | — | — | US | disclosed |