Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.44 |
| ▸ | BAD | Q92934 | 1/20 | 0.44 |
| ▸ | HDAC3 | O15379 | 3/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.43 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | APP | P05067 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | HSD11B1 | P28845 | 3/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | FABP4 | P15090 | 4/20 | 0.39 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.39 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.39 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.38 |
| ▸ | MMP1 | P03956 | 1/20 | 0.38 |
| ▸ | MMP13 | P45452 | 1/20 | 0.38 |
| ▸ | ACLY | P53396 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL2362049 | 0.86 | TACR3 (0.44) | HDAC1HTTSCN9A | |
| SCHEMBL12614912 | 0.85 | CHRNA7 (0.47) | BCL2L1BADHDAC3HDAC1HDAC2 | |
| SCHEMBL17924792 | 0.84 | CYP2C19 (0.54) | CYP2C19CYP3A4APPCYP2C9HSD11B1 | |
| SCHEMBL28547259 | 0.82 | NPC1 (0.44) | HDAC3HDAC1HDAC2HDAC6CYP3A4 | |
| SCHEMBL19282949 | 0.82 | PDE2A (0.51) | HDAC3HDAC1HDAC2HDAC6APP | |
| SCHEMBL17924794 | 0.79 | OPRM1 (0.46) | HDAC3HDAC1HDAC2HDAC6MAPK1 | |
| SCHEMBL30299580 | 0.79 | CYP2C19 (0.58) | HDAC3HDAC1HDAC2HDAC6CYP2C19 | |
| SCHEMBL16007059 | 0.79 | KDR (0.40) | BCL2L1BADHDAC3HDAC1HDAC2 | |
| SCHEMBL2363242 | 0.77 | HTT (0.48) | HDAC3HDAC1HDAC2HDAC6HTT | |
| SCHEMBL16797786 | 0.77 | CTSD (0.42) | ACLY |
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-107080747-B | Glucosylceramide synthase inhibitors | 建新公司 | 2021-02-26 | — | — | CN | disclosed |