Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 3/20 | 0.48 |
| ▸ | HDAC3 | O15379 | 3/20 | 0.46 |
| ▸ | CCR3 | P51677 | 1/20 | 0.43 |
| ▸ | ECE2 | P0DPD6 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | PKM | P14618 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.40 |
| ▸ | CDK2 | P24941 | 1/20 | 0.40 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.40 |
| ▸ | SYK | P43405 | 1/20 | 0.40 |
| ▸ | AIMP2 | Q13155 | 1/20 | 0.40 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.39 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.39 |
| ▸ | ORAI1 | Q96D31 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL22587986 | 1.00 | MAPK1 (0.48) | MAPK1HDAC3CCR3ECE2MAPT | |
| SCHEMBL22605517 | 0.85 | HDAC3 (0.60) | HDAC3CCR3ECE2CCNE1CDK2 | |
| SCHEMBL31285852 | 0.85 | HDAC3 (0.60) | HDAC3CCR3ECE2CCNE1CDK2 | |
| SCHEMBL28527229 | 0.84 | SYK (0.41) | CCR3ECE2SYKTRPV1 | |
| SCHEMBL30317154 | 0.83 | HDAC3 (0.48) | HDAC3CCR3ECE2ALDH1A1CCNE1 | |
| SCHEMBL22605817 | 0.82 | HDAC3 (0.52) | HDAC3CCR3ECE2MAPTALDH1A1 | |
| SCHEMBL28527704 | 0.79 | MAPK1 (0.53) | MAPK1MAPTPKMRAB9AALDH1A1 | |
| SCHEMBL31285863 | 0.78 | MAPK1 (0.56) | MAPK1ALDH1A1SIGMAR1NPSR1 | |
| SCHEMBL22605881 | 0.78 | MAPK1 (0.53) | MAPK1MAPTPKMRAB9AALDH1A1 | |
| SCHEMBL22587877 | 0.78 | MAPK1 (0.56) | MAPK1ALDH1A1SIGMAR1NPSR1 |
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-111848598-B | Heterocyclic compound, application thereof and composition containing same | 健艾仕生物医药有限公司 | 2024-12-10 | — | — | CN | disclosed |