Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.41 |
| ▸ | GAA | P10253 | 3/20 | 0.41 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 6/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8049864 | 0.83 | KDM4E (0.44) | ALDH1A1NPSR1POLBKDM4EGAA | |
| SCHEMBL8044921 | 0.82 | ALDH1A1 (0.44) | ALDH1A1NPSR1POLBKDM4EGAA | |
| SCHEMBL8051552 | 0.82 | KDM4E (0.53) | ALDH1A1NPSR1POLBKDM4EGAA | |
| SCHEMBL8051897 | 0.81 | RAB9A (0.41) | ALDH1A1NPSR1POLBKDM4EGAA | |
| SCHEMBL8042389 | 0.81 | TSHR (0.57) | ALDH1A1NPSR1KDM4EHSD17B10HPGD | |
| SCHEMBL8044125 | 0.79 | KDM4E (0.47) | ALDH1A1NPSR1POLBKDM4EGAA | |
| SCHEMBL8042322 | 0.79 | ALDH1A1 (0.42) | ALDH1A1NPSR1POLBKDM4EGAA | |
| SCHEMBL8043091 | 0.78 | TSHR (0.46) | ALDH1A1NPSR1KDM4EHSD17B10HPGD | |
| SCHEMBL8050181 | 0.78 | KDM4E (0.46) | ALDH1A1NPSR1POLBKDM4EGAA | |
| SCHEMBL8051692 | 0.77 | KDM4E (0.38) | ALDH1A1KDM4EGAAL3MBTL1HSD17B10 |
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-6080772-A | 2-AMINOTHIAZOLE TRIAZOLE OR TETRAZOLE COMPOUND FOR REGULATING PROTEIN TYROSINE PHOSPHATASE ACTIVITY | SUGEN, INC. (US) | 2000-06-27 | — | — | US | disclosed |