Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | MAOA | P21397 | 1/20 | 0.33 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.33 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.33 |
| ▸ | HTR2B | P41595 | 1/20 | 0.33 |
| ▸ | NMT1 | P30419 | 1/20 | 0.32 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.30 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.30 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL3186957 | 1.00 | CYP3A4 (0.33) | CYP3A4CHRM1ALOX15MAOATBXA2R | |
| Lithium Ion SCHEMBL28994757 | 0.80 | LMNA (0.34) | CYP3A4CHRM1ALOX15MAOATBXA2R | |
| SCHEMBL25210351 | 0.80 | CYP3A4 (0.35) | CYP3A4CHRM1ALOX15MAOATBXA2R | |
| SCHEMBL21999657 | 0.73 | ACLY (0.42) | CYP3A4CHRM1ALOX15TBXA2RADRA1A | |
| SCHEMBL16231411 | 0.72 | SIRT1 (0.40) | CYP3A4CHRM1ALOX15MAOATBXA2R | |
| SCHEMBL149954 | 0.72 | LMNA (0.37) | CYP3A4CHRM1TBXA2RMEN1KMT2A | |
| SCHEMBL21550442 | 0.72 | GAA (0.36) | CYP3A4CHRM1ALOX15MAOATBXA2R | |
| SCHEMBL1063904 | 0.71 | CES1 (0.38) | ALDH1A1MAPT | |
| SCHEMBL2263745 | 0.70 | RAPGEF4 (0.40) | MEN1KMT2AGAA | |
| SCHEMBL1021882 | 0.70 | KMT2A (0.44) | CYP3A4MEN1KMT2AALDH1A1GAA |
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-116323965-A | Compositions, systems and methods for bioassays using dyes | 生命技术公司 | 2023-06-23 | — | — | CN | disclosed |
| CN-116075597-A | Energy transfer dye conjugates for use in bioassays | 生命技术公司 | 2023-05-05 | — | — | CN | disclosed |