Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIT | P10721 | 3/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | ABL1 | P00519 | 1/20 | 0.37 |
| ▸ | BCR | P11274 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 3/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | GRM1 | Q13255 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.34 |
| ▸ | AXL | P30530 | 1/20 | 0.34 |
| ▸ | PBRM1 | Q86U86 | 1/20 | 0.34 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8043200 | 0.89 | ALDH1A1 (0.43) | HSD17B10POLBHTTTDP1GAA | |
| SCHEMBL8033936 | 0.87 | ALDH1A1 (0.42) | HSD17B10POLBHTTKDM4EALDH1A1 | |
| SCHEMBL8044443 | 0.84 | ALDH1A1 (0.49) | HSD17B10POLBHTTTDP1KDM4E | |
| SCHEMBL8043905 | 0.83 | KDM4E (0.37) | HSD17B10CYP3A4CYP2C19HTTTDP1 | |
| SCHEMBL8044564 | 0.82 | CYP19A1 (0.48) | HSD17B10POLBCYP3A4CYP2C19HTT | |
| SCHEMBL8050838 | 0.81 | KDM4E (0.36) | HSD17B10POLBCYP3A4CYP2C19HTT | |
| SCHEMBL8044497 | 0.81 | HTT (0.33) | POLBHTTKDM4EALDH1A1 | |
| SCHEMBL8037043 | 0.81 | SMN1; SMN2 (0.39) | HSD17B10HTTTDP1GAAKDM4E | |
| SCHEMBL8047017 | 0.80 | HSP90AA1 (0.44) | HSD17B10POLBCYP2C9CYP2C19HTT | |
| SCHEMBL8043941 | 0.80 | PTGS2 (0.37) | HSD17B10POLBCYP3A4CYP2D6CYP2C9 |
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 |