Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.38 |
| ▸ | DAO | P14920 | 1/20 | 0.36 |
| ▸ | RXRA | P19793 | 1/20 | 0.35 |
| ▸ | RXRB | P28702 | 1/20 | 0.35 |
| ▸ | RXRG | P48443 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.33 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
| ▸ | TP53 | P04637 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 4/20 | 0.32 |
| ▸ | PPARG | P37231 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 3/20 | 0.31 |
| ▸ | HPGD | P15428 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8716132 | 0.87 | HDAC6 (0.37) | ALDH1A1KMT2AMAPTHTTTP53 | |
| SCHEMBL8042066 | 0.86 | RXRA (0.39) | ALDH1A1DAORXRARXRBRXRG | |
| SCHEMBL8042658 | 0.83 | KMT2A (0.42) | ALDH1A1KMT2AMAPTHTTTP53 | |
| SCHEMBL8051983 | 0.83 | MAPT (0.39) | ALDH1A1RXRARXRBRXRGKMT2A | |
| SCHEMBL8043315 | 0.82 | ALDH1A1 (0.37) | ALDH1A1DAORXRARXRBRXRG | |
| SCHEMBL8044465 | 0.81 | ALDH1A1 (0.51) | ALDH1A1KMT2AMAPTHTTTP53 | |
| SCHEMBL8050406 | 0.81 | ALDH1A1 (0.33) | ALDH1A1KMT2AMAPTHTTTP53 | |
| SCHEMBL8049831 | 0.79 | HDAC6 (0.38) | ALDH1A1KMT2AMAPTHTTTP53 | |
| SCHEMBL8045818 | 0.79 | HPGD (0.51) | ALDH1A1KMT2AMAPTHTTTP53 | |
| SCHEMBL8046585 | 0.79 | RXRA (0.43) | ALDH1A1DAORXRARXRBRXRG |
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 |