Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 9/20 | 0.72 |
| ▸ | GSK3A | P49840 | 8/20 | 0.72 |
| ▸ | CDK5 | Q00535 | 8/20 | 0.72 |
| ▸ | CDK5R1 | Q15078 | 8/20 | 0.72 |
| ▸ | CCNB2 | O95067 | 7/20 | 0.72 |
| ▸ | CDK1 | P06493 | 7/20 | 0.72 |
| ▸ | CCNB1 | P14635 | 7/20 | 0.72 |
| ▸ | CCNB3 | Q8WWL7 | 7/20 | 0.72 |
| ▸ | MAPT | P10636 | 6/20 | 0.72 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.72 |
| ▸ | MEN1 | O00255 | 4/20 | 0.72 |
| ▸ | USP2 | O75604 | 4/20 | 0.72 |
| ▸ | RAB9A | P51151 | 4/20 | 0.72 |
| ▸ | LMNA | P02545 | 3/20 | 0.72 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.72 |
| ▸ | ALOX5 | P09917 | 3/20 | 0.72 |
| ▸ | FLT3 | P36888 | 3/20 | 0.72 |
| ▸ | NPC1 | O15118 | 2/20 | 0.72 |
| ▸ | TP53 | P04637 | 2/20 | 0.72 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.72 |
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 | |
|---|---|---|---|---|
| Indirubin-3-Monoxime SCHEMBL29354191 | 0.84 | CDK5R1 (1.00) | GSK3BGSK3ACDK5CDK5R1CCNB2 | |
| SCHEMBL28543343 | 0.80 | KMT2A (0.61) | GSK3BGSK3ACDK5CDK5R1CCNB2 | |
| SCHEMBL11174102 | 0.76 | AHR (0.55) | GSK3BGSK3ACDK5CDK5R1CCNB2 | |
| SCHEMBL23483898 | 0.76 | KMT2A (1.00) | CDK1MAPTKMT2AMEN1USP2 | |
| SCHEMBL30260525 | 0.76 | KMT2A (1.00) | CDK1MAPTKMT2AMEN1USP2 | |
| SCHEMBL23483889 | 0.75 | MAPT (0.72) | GSK3BMAPTKMT2AMEN1USP2 | |
| SCHEMBL30260468 | 0.75 | MAPT (0.72) | GSK3BMAPTKMT2AMEN1USP2 | |
| SCHEMBL4064946 | 0.74 | CDK5 (0.60) | GSK3BGSK3ACDK5CDK5R1CCNB2 | |
| SCHEMBL30260471 | 0.74 | MAPT (0.67) | GSK3BMAPTKMT2AMEN1USP2 | |
| SCHEMBL23483661 | 0.72 | RAB9A (0.72) | GSK3BMAPTKMT2AMEN1USP2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-110452225-B | Triazole ethyl isatin derivative and preparation method and application thereof | 西南大学 | 2022-09-09 | — | — | CN | disclosed |