Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.59 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.53 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.53 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.48 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.48 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL20135772 | 0.89 | TAAR1 (0.73) | TAAR1PTGS1PTGS2ADRA2AADRA2B | |
| SCHEMBL6333918 | 0.85 | TAAR1 (0.57) | TAAR1PTGS1PTGS2ADRA2AADRA2B | |
| SCHEMBL20146704 | 0.84 | TAAR1 (0.73) | TAAR1PTGS1PTGS2ADRA2AADRA2B | |
| SCHEMBL2885846 | 0.82 | TAAR1 (0.53) | TAAR1PTGS1PTGS2ADRA2AADRA2B | |
| SCHEMBL8571535 | 0.81 | TAAR1 (0.70) | TAAR1PTGS1PTGS2ADRA2AADRA2B | |
| SCHEMBL6734915 | 0.81 | TAAR1 (0.70) | TAAR1PTGS1PTGS2ADRA2AADRA2B | |
| SCHEMBL7116263 | 0.81 | TAAR1 (0.70) | TAAR1PTGS1PTGS2ADRA2AADRA2B | |
| SCHEMBL8921330 | 0.81 | TAAR1 (0.57) | TAAR1ADRA2AADRA2BADRA2CTSHR | |
| SCHEMBL9808857 | 0.79 | TAAR1 (0.55) | TAAR1ADRA2AADRA2BADRA2CTSHR | |
| SCHEMBL9936845 | 0.79 | TAAR1 (0.55) | TAAR1ADRA2AADRA2BADRA2CTSHR |
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-114605619-B | Organic photovoltaic device active layer material containing star-structure flexible chain segments, and preparation and application thereof | 华南理工大学 | 2023-12-29 | — | — | CN | disclosed |
| CN-114605619-A | Active layer material of organic photovoltaic device containing star-structure flexible chain segment and preparation and application thereof | 华南理工大学 | 2022-06-10 | — | — | CN | disclosed |