Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 5/20 | 0.60 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.58 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.58 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.40 |
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | FLT3 | P36888 | 1/20 | 0.39 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.38 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.38 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL122911 | 0.84 | ACHE (0.57) | CYP19A1CHRNA7TDP1ACHEMEN1 | |
| SCHEMBL29361168 | 0.84 | SLC6A2 (0.78) | CYP19A1SLC6A2SLC6A4SLC6A3CYP3A4 | |
| Ammonia Solution, Strong SCHEMBL6000291 | 0.81 | CYP19A1 (0.42) | CYP19A1SLC6A2SLC6A4SLC6A3CYP3A4 | |
| SCHEMBL27430257 | 0.81 | CYP19A1 (0.42) | CYP19A1SLC6A2SLC6A4SLC6A3CYP3A4 | |
| SCHEMBL8737044 | 0.81 | CYP19A1 (0.59) | CYP19A1CYP3A4CYP2C19CHRNA7KMT2A | |
| SCHEMBL12951377 | 0.78 | MLKL (0.45) | CYP19A1SLC6A2SLC6A4SLC6A3CYP3A4 | |
| SCHEMBL15787497 | 0.78 | CYP3A4 (0.54) | CYP19A1SLC6A2SLC6A4SLC6A3CYP3A4 | |
| SCHEMBL15787302 | 0.78 | CYP3A4 (0.54) | CYP19A1SLC6A2SLC6A4SLC6A3CYP3A4 | |
| SCHEMBL6504970 | 0.76 | CYP19A1 (0.39) | CYP19A1SLC6A2SLC6A4SLC6A3CYP3A4 | |
| Ammonia Solution, Strong SCHEMBL5999950 | 0.76 | CYP17A1 (0.57) | CYP19A1SLC6A2SLC6A4SLC6A3CYP3A4 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4950674-A | Arylalkylheterocyclic amines,N-substituted by aryloxyalkyl group in a method for allergy treatment | A. H. ROBINS COMPANY, INCORPORATED (US) | 1990-08-21 | — | — | US | disclosed |
| US-4810713-A | Arylalkyl-heterocyclic amines, n-substituted by aryloxyalkyl groups used in a method for allergy treatment | A. H. ROBINS COMPANY, INCORPORATED (US) | 1989-03-07 | — | — | US | disclosed |
| US-4138488-A | Diphenylmethyl picolinic acid derivatives and their use as anti-acne agents | SCHERING CORPORATION (US) | 1979-02-06 | — | — | US | disclosed |