Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 7/20 | 0.58 |
| ▸ | LMNA | P02545 | 4/20 | 0.58 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.58 |
| ▸ | HTT | P42858 | 2/20 | 0.58 |
| ▸ | CES2 | O00748 | 1/20 | 0.58 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.58 |
| ▸ | GLA | P06280 | 1/20 | 0.58 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.58 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.58 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.58 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.58 |
| ▸ | TSHR | P16473 | 1/20 | 0.58 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.58 |
| ▸ | AADAC | P22760 | 1/20 | 0.58 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.58 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.58 |
| ▸ | HTR6 | P50406 | 1/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL3529901 | 0.85 | LMNA (0.64) | ARLMNAMAPK1CYP3A4HTT | |
| SCHEMBL3246949 | 0.82 | AR (0.59) | ARLMNAMAPK1CYP3A4HTT | |
| SCHEMBL30554610 | 0.82 | AR (0.59) | ARLMNAMAPK1CYP3A4HTT | |
| SCHEMBL21949037 | 0.80 | MAPT (0.53) | ARLMNAHTTHDAC3HDAC1 | |
| SCHEMBL28389908 | 0.80 | KDR (0.61) | LMNAHTTHDAC1HDAC6MAPT | |
| SCHEMBL4250921 | 0.79 | MEN1 (0.58) | ARLMNAMAPK1CYP3A4HTT | |
| SCHEMBL4959122 | 0.78 | AR (0.71) | ARLMNAMAPK1CYP3A4HTT | |
| SCHEMBL4959126 | 0.78 | AR (0.71) | ARLMNAMAPK1CYP3A4HTT | |
| SCHEMBL30554578 | 0.78 | AR (0.57) | ARLMNAMAPK1CYP3A4HTT | |
| SCHEMBL3246599 | 0.78 | AR (0.57) | ARLMNAMAPK1CYP3A4HTT |
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-2017031041-A1 | FUNCTIONALIZED AMINOBENZOBOROXOLES | CHANNEL THERAPEUTICS, INC. (US) | 2017-02-23 | — | — | WO | disclosed |