Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 1/20 | 0.40 |
| ▸ | DDB1 | Q16531 | 2/20 | 0.36 |
| ▸ | CRBN | Q96SW2 | 2/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.32 |
| ▸ | HTR2C | P28335 | 1/20 | 0.32 |
| ▸ | HTR2B | P41595 | 1/20 | 0.32 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.31 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.31 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.31 |
| ▸ | TACR1 | P25103 | 1/20 | 0.31 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL4982091 | 0.68 | BACE1 (0.43) | BACE1DDB1CRBNHDAC6S1PR1 | |
| SCHEMBL20536062 | 0.66 | HTR5A (0.32) | HTR2AHTR2C | |
| SCHEMBL9913098 | 0.66 | BACE1 (0.51) | BACE1DDB1CRBNSLC6A2SLC6A4 | |
| SCHEMBL28261134 | 0.65 | DDB1 (0.36) | BACE1DDB1CRBNHDAC6SLC6A9 | |
| SCHEMBL2619978 | 0.64 | BACE1 (0.40) | BACE1DDB1CRBNHDAC6SCN9A | |
| SCHEMBL4654446 | 0.62 | RXRA (0.47) | DDB1CRBNSLC6A2SLC6A4SCN9A | |
| SCHEMBL18769575 | 0.61 | BACE1 (0.38) | BACE1HDAC6 | |
| SCHEMBL760881 | 0.61 | BACE1 (0.36) | BACE1DDB1CRBNHDAC6SLC6A9 | |
| SCHEMBL760883 | 0.61 | BACE1 (0.36) | BACE1DDB1CRBNHDAC6SLC6A9 | |
| SCHEMBL3020481 | 0.60 | BACE1 (0.40) | BACE1DDB1CRBNHTR2AHTR2C |
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 |
|---|---|---|---|---|---|---|---|
| EP-3612520-A1 | AN ISOXAZOLE DERIVATIVES AS NUCLEAR RECEPTOR AGONISTS AND USED THEREOF | Il Dong Pharmaceutical Co., Ltd. (KR) | 2020-02-26 | — | — | EP | disclosed |
| WO-2018190643-A1 | AN ISOXAZOLE DERIVATIVES AS NUCLEAR RECEPTOR AGONISTS AND USED THEREOF | IL DONG PHARMACEUTICAL CO., LTD. (KR) | 2018-10-18 | — | — | WO | disclosed |