Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR5A | P47898 | 1/20 | 0.35 |
| ▸ | CD44 | P16070 | 1/20 | 0.34 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.34 |
| ▸ | BAD | Q92934 | 1/20 | 0.34 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.33 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | CA7 | P43166 | 1/20 | 0.31 |
| ▸ | CA9 | Q16790 | 1/20 | 0.31 |
| ▸ | CNR2 | P34972 | 1/20 | 0.31 |
| ▸ | HTR1A | P08908 | 1/20 | 0.30 |
| ▸ | HTR1B | P28222 | 1/20 | 0.30 |
| ▸ | HTR2A | P28223 | 1/20 | 0.30 |
| ▸ | HTR2C | P28335 | 1/20 | 0.30 |
| ▸ | HTR7 | P34969 | 1/20 | 0.30 |
| ▸ | HTR6 | P50406 | 1/20 | 0.30 |
| ▸ | TRPA1 | O75762 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL22989888 | 0.80 | HTR5A (0.37) | HTR5ACD44HDAC4ALDH1A1CA1 | |
| SCHEMBL28217583 | 0.77 | CD44 (0.39) | HTR5ACD44HDAC4ALDH1A1ALOX12 | |
| SCHEMBL28304053 | 0.74 | LMNA (0.33) | MAP2K1 | |
| SCHEMBL28303988 | 0.74 | — | — | |
| SCHEMBL25027774 | 0.74 | CD44 (0.38) | HTR5ACD44ALDH1A1MAP2K1CA1 | |
| SCHEMBL14712000 | 0.73 | KDM1A (0.42) | HTR5ACD44BCL2L1BADHDAC4 | |
| SCHEMBL23832859 | 0.69 | KDM1A (0.46) | ALDH1A1HTR2ACYP1A2 | |
| SCHEMBL23908644 | 0.69 | KDM1A (0.46) | ALDH1A1HTR2ACYP1A2 | |
| SCHEMBL25507726 | 0.69 | MAP2K1 (0.38) | HTR5ACD44ALDH1A1MAP2K1CA1 | |
| SCHEMBL19010372 | 0.69 | TRPA1 (0.39) | HTR5ACD44BCL2L1BADALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105792821-B | Therapeutic and/or prophylactic agent for pain comprising 1-indansulfamide derivative | 卫材R&D管理有限公司 | 2018-05-04 | — | — | CN | disclosed |