Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 7/20 | 0.50 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.50 |
| ▸ | CA2 | P00918 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.43 |
| ▸ | ADRA2A | P08913 | 3/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.43 |
| ▸ | HTR1A | P08908 | 1/20 | 0.43 |
| ▸ | HTR3A | P46098 | 1/20 | 0.43 |
| ▸ | BACE1 | P56817 | 1/20 | 0.43 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | BLM | P54132 | 1/20 | 0.42 |
| ▸ | LTA4H | P09960 | 1/20 | 0.42 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL31402809 | 0.84 | MAOB (0.44) | TAAR1SLC5A1HPGDSLC5A2PTGS1 | |
| SCHEMBL20973256 | 0.82 | CES1 (0.49) | ALDH1A1TDP1HDAC2HDAC8POLB | |
| SCHEMBL31402812 | 0.78 | F2RL1 (0.53) | ALDH1A1TAAR1KMT2ATP53CYP3A4 | |
| SCHEMBL7632072 | 0.76 | FAAH (0.53) | ESR1ESR2CA2ALDH1A1KDM4E | |
| SCHEMBL14534212 | 0.74 | ESR1 (0.59) | ESR1ESR2CA2ALDH1A1KDM4E | |
| SCHEMBL10909669 | 0.72 | ESR1 (0.56) | ESR1ESR2CA2ALDH1A1KDM4E | |
| SCHEMBL2332824 | 0.70 | ESR1 (0.59) | ESR1ESR2CA2ALDH1A1KDM4E | |
| SCHEMBL22072542 | 0.70 | BACE1 (0.37) | KDM4EBACE1LMNA | |
| SCHEMBL69344 | 0.69 | ESR1 (1.00) | ESR1ESR2CA2ALDH1A1KDM4E | |
| SCHEMBL3873458 | 0.69 | ESR1 (1.00) | ESR1ESR2CA2ALDH1A1KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| WO-2014165536-A1 | METHODS AND KITS FOR THE DIAGNOSIS OF INFLUENZA | BECTON, DICKINSON AND COMPANY (US) | 2014-10-09 | — | — | WO | disclosed |