Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 16/20 | 0.48 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.45 |
| ▸ | MAPT | P10636 | 4/20 | 0.45 |
| ▸ | HPGD | P15428 | 2/20 | 0.45 |
| ▸ | HTT | P42858 | 9/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 7/20 | 0.42 |
| ▸ | MEN1 | O00255 | 5/20 | 0.42 |
| ▸ | LMNA | P02545 | 4/20 | 0.42 |
| ▸ | TSHR | P16473 | 4/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | GLA | P06280 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.37 |
| ▸ | TP53 | P04637 | 2/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 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 | |
|---|---|---|---|---|
| SCHEMBL8044466 | 0.85 | ALDH1A1 (0.45) | ALDH1A1ADRB2HSD17B10SMN1; SMN2MAPT | |
| SCHEMBL8033926 | 0.82 | ALDH1A1 (0.43) | ALDH1A1HSD17B10SMN1; SMN2MAPTHPGD | |
| SCHEMBL8052220 | 0.81 | ALDH1A1 (0.54) | ALDH1A1HSD17B10SMN1; SMN2MAPTHPGD | |
| SCHEMBL8043251 | 0.81 | ALDH1A1 (0.49) | ALDH1A1ADRB2HSD17B10SMN1; SMN2MAPT | |
| SCHEMBL8048740 | 0.78 | ALDH1A1 (0.50) | ALDH1A1ADRB2HSD17B10SMN1; SMN2MAPT | |
| SCHEMBL8051157 | 0.77 | ALDH1A1 (0.45) | ALDH1A1ADRB2HSD17B10SMN1; SMN2MAPT | |
| SCHEMBL8050620 | 0.77 | ALDH1A1 (0.55) | ALDH1A1ADRB2HSD17B10SMN1; SMN2MAPT | |
| SCHEMBL8043452 | 0.77 | ALDH1A1 (0.51) | ALDH1A1ADRB2HSD17B10SMN1; SMN2MAPT | |
| SCHEMBL8050047 | 0.76 | ALDH1A1 (0.48) | ALDH1A1ADRB2HSD17B10SMN1; SMN2MAPT | |
| SCHEMBL8043940 | 0.76 | ALDH1A1 (0.43) | ALDH1A1HSD17B10SMN1; SMN2MAPTHPGD |
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 |