Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.54 |
| ▸ | NPC1 | O15118 | 4/20 | 0.44 |
| ▸ | RAB9A | P51151 | 4/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | PKM | P14618 | 2/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | RXRA | P19793 | 1/20 | 0.40 |
| ▸ | RXRB | P28702 | 1/20 | 0.40 |
| ▸ | RXRG | P48443 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | GSK3B | P49841 | 1/20 | 0.40 |
| ▸ | ELANE | P08246 | 2/20 | 0.39 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8050726 | 0.82 | KDM4E (0.44) | NPC1RAB9AALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL8052110 | 0.80 | ALDH1A1 (0.45) | HDAC6NPC1RAB9AALDH1A1SMN1; SMN2 | |
| SCHEMBL8032493 | 0.79 | RAB9A (0.44) | NPC1RAB9AALDH1A1SMN1; SMN2MEN1 | |
| SCHEMBL6497988 | 0.79 | HDAC6 (0.49) | HDAC6NPC1RAB9AALDH1A1MAPT | |
| SCHEMBL8050254 | 0.78 | HDAC6 (0.45) | HDAC6NPC1RAB9AALDH1A1SMN1; SMN2 | |
| SCHEMBL8048020 | 0.78 | HCAR2 (0.56) | NPC1RAB9AALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL8045484 | 0.77 | HDAC6 (0.57) | HDAC6NPC1RAB9AALDH1A1SMN1; SMN2 | |
| SCHEMBL8050918 | 0.77 | MAPK8 (0.55) | NPC1RAB9AALDH1A1MAPTPKM | |
| SCHEMBL8042976 | 0.76 | HDAC6 (0.43) | HDAC6NPC1RAB9AALDH1A1SMN1; SMN2 | |
| SCHEMBL8042773 | 0.76 | MAPK8 (0.61) | HDAC6NPC1RAB9AALDH1A1MAPT |
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 |