Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 2/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | CA4 | P22748 | 1/20 | 0.35 |
| ▸ | CA5A | P35218 | 1/20 | 0.35 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 3/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.34 |
| ▸ | GSK3B | P49841 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | TERT | O14746 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | TNF | P01375 | 1/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8042113 | 0.82 | HDAC6 (0.43) | HDAC6ALDH1A1POLBPKMATM | |
| SCHEMBL8050088 | 0.78 | KDM4E (0.45) | ALDH1A1PKMMEN1KMT2ANPC1 | |
| SCHEMBL8042376 | 0.78 | ALDH1A1 (0.45) | HDAC6ALDH1A1POLBMEN1KMT2A | |
| SCHEMBL8042760 | 0.77 | ATM (0.47) | ALDH1A1POLBATMMEN1KMT2A | |
| SCHEMBL8048725 | 0.76 | ALDH1A1 (0.53) | HDAC6ALDH1A1POLBATMKMT2A | |
| SCHEMBL28353372 | 0.75 | HDAC6 (0.64) | HDAC6ALDH1A1POLBPKMATM | |
| SCHEMBL8050637 | 0.74 | HDAC6 (0.49) | HDAC6ALDH1A1POLBPKMMEN1 | |
| SCHEMBL8034279 | 0.73 | HDAC6 (0.45) | HDAC6ALDH1A1POLBPKMATM | |
| SCHEMBL14832839 | 0.73 | ALDH1A1 (0.43) | ALDH1A1POLBPKMMEN1KMT2A | |
| SCHEMBL8045096 | 0.71 | PDPK1 (0.51) | HDAC6ALDH1A1POLBPKMATM |
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 |