Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR6 | P50406 | 14/20 | 0.42 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 2/20 | 0.38 |
| ▸ | CA2 | P00918 | 2/20 | 0.38 |
| ▸ | CA4 | P22748 | 2/20 | 0.38 |
| ▸ | CA9 | Q16790 | 2/20 | 0.38 |
| ▸ | HTR2A | P28223 | 2/20 | 0.37 |
| ▸ | HTR2C | P28335 | 2/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| Fluoride SCHEMBL28061775 | 0.98 | HTR6 (0.41) | HTR6CHRM2CHRM1CA1CA2 | |
| SCHEMBL30407459 | 0.81 | CHRM2 (0.43) | HTR6CHRM2CHRM1HTR2AHTR2C | |
| SCHEMBL3796418 | 0.80 | SLC6A2 (0.49) | HTR6CHRM2CHRM1HTR2AHTR2C | |
| SCHEMBL3958698 | 0.80 | CA1 (0.45) | HTR6CHRM2CHRM1CA1CA2 | |
| SCHEMBL6744243 | 0.79 | CA1 (0.44) | HTR6CHRM2CHRM1CA1CA2 | |
| SCHEMBL7462033 | 0.78 | HTR6 (0.39) | HTR6CHRM2CHRM1CA1CA2 | |
| SCHEMBL28061741 | 0.78 | KMT2A (0.45) | CA1CA2CA4CA9SIGMAR1 | |
| SCHEMBL10979646 | 0.76 | CA1 (0.39) | HTR6CHRM2CHRM1CA1CA2 | |
| SCHEMBL10974784 | 0.76 | CA1 (0.39) | HTR6CHRM2CHRM1CA1CA2 | |
| SCHEMBL28440794 | 0.75 | SLC6A2 (0.41) | HTR6CHRM2CHRM1HTR2C |
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-105601641-B | 7 piperazine sulfonamide camptothecine compounds, Preparation method and uses | 兰州大学 | 2018-01-16 | — | — | CN | disclosed |
| CN-105601641-A | 7-position piperazine sulfonamide camptothecin compounds, preparation method and application | UNIV LANZHOU | 2016-05-25 | — | — | CN | disclosed |