Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 7/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 4/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 4/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | RAB9A | P51151 | 3/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | USP2 | O75604 | 4/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8042984 | 0.88 | TSHR (0.50) | HSD17B10ALDH1A1NPSR1KDM4ECYP1A2 | |
| SCHEMBL8043995 | 0.86 | SMN1; SMN2 (0.53) | HSD17B10ALDH1A1NPSR1KDM4ECYP1A2 | |
| SCHEMBL8050857 | 0.86 | HSD17B10 (0.48) | HSD17B10ALDH1A1NPSR1KDM4ECYP1A2 | |
| SCHEMBL8046376 | 0.85 | SMN1; SMN2 (0.41) | HSD17B10ALDH1A1NPSR1KDM4EMAPT | |
| SCHEMBL8050258 | 0.84 | ALDH1A1 (0.49) | HSD17B10ALDH1A1NPSR1KDM4ECYP1A2 | |
| SCHEMBL8042533 | 0.84 | HDAC6 (0.53) | HSD17B10ALDH1A1NPSR1KDM4ECYP3A4 | |
| SCHEMBL8043248 | 0.83 | HSD17B10 (0.44) | HSD17B10ALDH1A1NPSR1KDM4ECYP1A2 | |
| SCHEMBL8034389 | 0.82 | RECQL (0.46) | HSD17B10ALDH1A1NPSR1KDM4ECYP1A2 | |
| SCHEMBL8048014 | 0.82 | HSD17B10 (0.57) | HSD17B10ALDH1A1NPSR1KDM4ECYP1A2 | |
| SCHEMBL8032397 | 0.82 | HSD17B10 (0.44) | HSD17B10ALDH1A1NPSR1KDM4ECYP1A2 |
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 |