Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ENPP2 | Q13822 | 4/20 | 0.40 |
| ▸ | LTA4H | P09960 | 3/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.39 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.38 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.38 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.38 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.35 |
| ▸ | TXNRD1 | Q16881 | 1/20 | 0.35 |
| ▸ | TXNRD3 | Q86VQ6 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL30063063 | 0.85 | LTA4H (0.56) | LTA4HPTGS2PTGS1HRH3MEN1 | |
| SCHEMBL545206 | 0.85 | LTA4H (0.56) | LTA4HPTGS2PTGS1HRH3MEN1 | |
| SCHEMBL13400004 | 0.80 | ALDH1A1 (0.42) | ENPP2SMN1; SMN2ALDH1A1TDP1CYP3A4 | |
| SCHEMBL30061835 | 0.78 | ENPP2 (0.42) | ENPP2SMN1; SMN2MEN1KMT2AALDH1A1 | |
| SCHEMBL16055917 | 0.77 | RAB9A (0.48) | LTA4HPTGS2PTGS1SMN1; SMN2MEN1 | |
| SCHEMBL30697141 | 0.77 | RAB9A (0.48) | LTA4HPTGS2PTGS1SMN1; SMN2MEN1 | |
| SCHEMBL1264295 | 0.75 | ALDH1A1 (0.41) | ENPP2SMN1; SMN2ALDH1A1TDP1CYP3A4 | |
| SCHEMBL1603675 | 0.75 | LMNA (0.49) | SMN1; SMN2MEN1KMT2AALDH1A1TDP1 | |
| SCHEMBL14279323 | 0.75 | MAPT (0.38) | ENPP2SMN1; SMN2ALDH1A1TDP1CYP3A4 | |
| SCHEMBL3155181 | 0.75 | ALDH1A1 (0.39) | ENPP2SMN1; SMN2MEN1KMT2AALDH1A1 |
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-115340552-A | Heterocyclic derivative and application thereof in medicine | 四川海思科制药有限公司 | 2022-11-15 | — | — | CN | disclosed |