Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 4/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.51 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.51 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.51 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.49 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.49 |
| ▸ | CFTR | P13569 | 1/20 | 0.46 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.46 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.46 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.46 |
| ▸ | GOPC | Q9HD26 | 1/20 | 0.46 |
| ▸ | HTR2A | P28223 | 1/20 | 0.46 |
| ▸ | HRH1 | P35367 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL3637324 | 0.85 | KCNH2 (0.63) | CYP2C19KCNH2SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL23970158 | 0.84 | TBXAS1 (0.56) | EPHX2CYP2C9CYP2C19KCNN4KCNA5 | |
| SCHEMBL9910965 | 0.81 | TBXAS1 (0.61) | EPHX2CYP2C9CYP2C19KCNN4KCNA5 | |
| SCHEMBL659775 | 0.80 | CFTR (0.53) | EPHX2CYP2C9CYP2C19KCNN4KCNA5 | |
| SCHEMBL14288463 | 0.80 | TBXAS1 (0.64) | EPHX2CYP2C9CYP2C19KCNN4KCNA5 | |
| SCHEMBL15130958 | 0.77 | SLC6A2 (0.70) | EPHX2CYP2C9CYP2C19KCNN4KCNA5 | |
| SCHEMBL1944201 | 0.77 | CFTR (0.59) | KCNN4KCNA5TBXAS1KCNH2CFTR | |
| SCHEMBL11796932 | 0.76 | KCNH2 (0.76) | EPHX2CYP2C19KCNH2SLC6A2SLC6A4 | |
| SCHEMBL126320 | 0.75 | CASR (0.54) | LMNASMN1; SMN2 | |
| Ammonia Solution, Strong SCHEMBL5999698 | 0.75 | CFTR (0.57) | KCNN4KCNA5TBXAS1KCNH2CFTR |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1129070-A4 | NEUROTROPHIC DIAMIDE AND CARBAMATE AGENTS | BRISTOL MYERS SQUIBB CO (US) | 2005-03-02 | — | — | EP | disclosed |
| EP-1129070-A1 | NEUROTROPHIC DIAMIDE AND CARBAMATE AGENTS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2001-09-05 | — | — | EP | disclosed |
| US-6228872-B1 | PEPTIDE-PROLYL ISOMERASE AND ROTAMASE INHIBITORS | BRISTOL-MYERS SQUIBB COMPANY | 2001-05-08 | — | — | US | disclosed |
| WO-2000027811-A1 | NEUROTROPHIC DIAMIDE AND CARBAMATE AGENTS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2000-05-18 | — | — | WO | disclosed |