Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 2/20 | 0.53 |
| ▸ | CA2 | P00918 | 2/20 | 0.53 |
| ▸ | HTR6 | P50406 | 2/20 | 0.51 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.43 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.43 |
| ▸ | IDO1 | P14902 | 2/20 | 0.43 |
| ▸ | RET | P07949 | 1/20 | 0.42 |
| ▸ | HTR2A | P28223 | 1/20 | 0.42 |
| ▸ | MAOA | P21397 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.40 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL2464698 | 0.83 | CA1 (0.50) | CA1CA2HTR6MTNR1AMTNR1B | |
| SCHEMBL27472540 | 0.80 | CRBN (0.56) | CA1CA2HTR6MTNR1AMTNR1B | |
| SCHEMBL9115029 | 0.80 | HTR6 (0.54) | HTR6MTNR1AMTNR1BIDO1MAOA | |
| SCHEMBL8335967 | 0.78 | SRD5A1 (0.43) | CA1CA2HTR6HTR2A | |
| SCHEMBL61507 | 0.76 | HTR6 (0.59) | HTR6MTNR1AMTNR1BIDO1RET | |
| SCHEMBL29681415 | 0.76 | HTR6 (0.59) | HTR6MTNR1AMTNR1BIDO1RET | |
| SCHEMBL1568298 | 0.76 | HTR6 (0.54) | CA1CA2HTR6MTNR1AMTNR1B | |
| SCHEMBL62360 | 0.76 | HTR6 (0.59) | HTR6MTNR1AMTNR1BIDO1RET | |
| SCHEMBL12711176 | 0.75 | HTR6 (0.41) | CA1CA2HTR6MTNR1AMTNR1B | |
| Hydrochloric Acid SCHEMBL15818880 | 0.74 | HTR6 (0.57) | HTR6MTNR1AMTNR1BIDO1RET |
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 |
|---|---|---|---|---|---|---|---|
| CN-111683662-B | Substituted pyrimidine compounds, pharmaceutical compositions and methods of treatment | 陈志宏 | 2024-04-02 | — | — | CN | disclosed |
| US-7745471-B2 | Derivatives of 1,2-benzisoxazole-3-methane sulfonic acid as novel intermediates for the synthesis of zonisamide | CHEMAGIS LTD. (IL) | 2010-06-29 | — | — | US | disclosed |