Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR3 | P51677 | 4/20 | 0.43 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.40 |
| ▸ | ECE2 | P0DPD6 | 1/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.39 |
| ▸ | SCD | O00767 | 1/20 | 0.39 |
| ▸ | RORC | P51449 | 1/20 | 0.39 |
| ▸ | RBP4 | P02753 | 2/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.38 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.38 |
| ▸ | ORAI1 | Q96D31 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.37 |
| ▸ | CDK2 | P24941 | 1/20 | 0.37 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.37 |
| ▸ | CALCRL | Q16602 | 1/20 | 0.37 |
| ▸ | ITGB2 | P05107 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL31285877 | 1.00 | CCR3 (0.43) | CCR3TRPV1ECE2HDAC3SCD | |
| SCHEMBL29619918 | 0.85 | CCR3 (0.44) | CCR3TRPV1ECE2HDAC3SCD | |
| SCHEMBL29518321 | 0.84 | PLD2 (0.45) | CCR3TRPV1RORCRBP4CALCRL | |
| SCHEMBL22605644 | 0.84 | PLD2 (0.45) | CCR3TRPV1RORCRBP4CALCRL | |
| SCHEMBL22588684 | 0.82 | PLD2 (0.43) | CCR3TRPV1ECE2RORCRBP4 | |
| SCHEMBL31285924 | 0.82 | PLD2 (0.43) | CCR3TRPV1ECE2RORCRBP4 | |
| SCHEMBL22605544 | 0.81 | CCR3 (0.39) | CCR3TRPV1ECE2HDAC3SCD | |
| SCHEMBL30317255 | 0.80 | CCR3 (0.44) | CCR3TRPV1ECE2HDAC3RORC | |
| SCHEMBL22587931 | 0.80 | RORC (0.40) | CCR3TRPV1ECE2HDAC3RORC | |
| SCHEMBL30317048 | 0.80 | RORC (0.40) | CCR3TRPV1ECE2HDAC3RORC |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111848598-A | Heterocyclic ring-containing compound, application thereof and composition containing heterocyclic ring-containing compound | 健艾仕生物医药有限公司 | 2020-10-30 | — | — | CN | disclosed |
| WO-2020216378-A1 | HETEROCYCLIC COMPOUND, APPLICATION THEREOF, AND COMPOSITION CONTAINING SAME | 健艾仕生物医药有限公司 | 2020-10-29 | — | — | WO | disclosed |