Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 3/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | PGR | P06401 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.36 |
| ▸ | AR | P10275 | 1/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL30758146 | 0.71 | HPGD (0.41) | CYP1A2CYP2A6MEN1KMT2ANPC1 | |
| SCHEMBL27860576 | 0.71 | KDM1A (0.38) | CYP2A6MEN1KMT2ANPC1SLC6A2 | |
| SCHEMBL28132004 | 0.70 | CYP2A6 (0.36) | CYP1A2CYP2A6MEN1KMT2ASLC6A2 | |
| SCHEMBL6860924 | 0.68 | BRD4 (0.47) | CYP1A2CYP2A6MEN1KMT2ACYP2C19 | |
| SCHEMBL1313656 | 0.68 | CYP1A2 (0.33) | CYP1A2MEN1KMT2ASLC6A2SLC6A3 | |
| SCHEMBL5025415 | 0.68 | CYP2A6 (0.33) | CYP1A2CYP2A6NPC1RAB9ASLC6A2 | |
| SCHEMBL28124535 | 0.67 | ALDH1A1 (0.39) | SLC6A2SLC6A3SLC6A4CYP3A4ALOX15 | |
| SCHEMBL27915969 | 0.67 | CYP1A2 (0.35) | CYP1A2SLC6A2SLC6A3SLC6A4HPGD | |
| SCHEMBL4083224 | 0.67 | — | — | |
| SCHEMBL4609520 | 0.67 | PTGDR2 (0.50) | MEN1KMT2ANPC1RAB9AHPGD |
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-117384099-A | Ratio colorimetric fluorescent probe and preparation method and application thereof | 华南农业大学 | 2024-01-12 | — | — | CN | disclosed |