Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | ABL1 | P00519 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.35 |
| ▸ | CDK1 | P06493 | 1/20 | 0.35 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8042760 | 0.88 | ATM (0.47) | ALDH1A1HSD17B10LMNAHPGDHTT | |
| SCHEMBL8046506 | 0.83 | ALDH1A1 (0.40) | ALDH1A1HSD17B10LMNATSHRHPGD | |
| SCHEMBL8034393 | 0.78 | HDAC6 (0.48) | ALDH1A1LMNAKMT2AMEN1NPC1 | |
| SCHEMBL8042757 | 0.78 | CYP1A2 (0.53) | ALDH1A1HSD17B10LMNATSHRHPGD | |
| SCHEMBL8042037 | 0.76 | MEN1 (0.31) | KMT2AMEN1 | |
| SCHEMBL8044299 | 0.75 | ALDH1A1 (0.45) | ALDH1A1HSD17B10LMNATSHRGAA | |
| SCHEMBL8048154 | 0.74 | ALDH1A1 (0.48) | ALDH1A1LMNATSHRHTTSMN1; SMN2 | |
| SCHEMBL8043585 | 0.74 | — | — | |
| SCHEMBL8048610 | 0.73 | ALDH1A1 (0.46) | ALDH1A1HSD17B10LMNATSHRHPGD | |
| SCHEMBL8052229 | 0.73 | ALDH1A1 (0.43) | ALDH1A1HSD17B10LMNATSHRHPGD |
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 |