Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTNNB1 | P35222 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.43 |
| ▸ | MCL1 | Q07820 | 4/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.41 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.41 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.41 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8890206 | 0.89 | TDP1 (0.56) | CTNNB1TDP1MTNR1AMCL1KMT2A | |
| SCHEMBL1858161 | 0.83 | KMT2A (0.52) | CTNNB1TDP1MTNR1AMCL1KMT2A | |
| SCHEMBL8868645 | 0.80 | GRIK1 (0.51) | FOLH1CYP1A2 | |
| SCHEMBL8867961 | 0.80 | GRIK1 (0.51) | FOLH1CYP1A2 | |
| SCHEMBL8867562 | 0.80 | GRIK1 (0.51) | FOLH1CYP1A2 | |
| SCHEMBL1862472 | 0.78 | KMT2A (0.47) | TDP1MTNR1AMCL1KMT2A | |
| SCHEMBL10521472 | 0.76 | SIGMAR1 (0.52) | CTNNB1TDP1KMT2AFOLH1HRH4 | |
| SCHEMBL6680287 | 0.76 | CYP1A2 (0.48) | TDP1MTNR1AMCL1CYP1A2CYP2C19 | |
| SCHEMBL8868315 | 0.75 | GRIK1 (0.56) | TDP1FOLH1CYP1A2 | |
| SCHEMBL27584168 | 0.75 | TDP1 (0.54) | CTNNB1TDP1MTNR1AMCL1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-5599966-A | SUITABLE FOR TREATMENT OF DISEASES OF RESPIRATORY PASSAGES | BYK NEDERLAND BV (NL) | 1997-02-04 | — | — | US | disclosed |
| WO-1994008945-A1 | SUBSTITUTED ETHANOLAMINE ESTERS | BYK NEDERLAND BV (NL) | 1994-04-28 | — | — | WO | disclosed |