Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.56 |
| ▸ | RAB9A | P51151 | 3/20 | 0.56 |
| ▸ | LMNA | P02545 | 2/20 | 0.56 |
| ▸ | NPC1 | O15118 | 2/20 | 0.50 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.43 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL24435408 | 0.78 | DRD2 (0.48) | RAB9ANPC1MAPTKCNH2 | |
| SCHEMBL25456970 | 0.78 | DRD2 (0.47) | ALDH1A1RAB9ANPC1KCNH2MEN1 | |
| SCHEMBL12386859 | 0.77 | DRD2 (0.55) | ALDH1A1KCNH2POLB | |
| SCHEMBL14983617 | 0.77 | DRD2 (0.51) | ALDH1A1RAB9ALMNANPC1HPGD | |
| SCHEMBL8734239 | 0.74 | SLC18A3 (0.72) | ALDH1A1RAB9ALMNA | |
| SCHEMBL12609017 | 0.73 | HRH3 (0.56) | KCNH2 | |
| SCHEMBL2603285 | 0.73 | HRH3 (0.56) | KCNH2 | |
| SCHEMBL12609029 | 0.73 | HRH3 (0.56) | KCNH2 | |
| SCHEMBL6360566 | 0.72 | SIGMAR1 (0.63) | ALDH1A1RAB9ALMNAMEN1KMT2A | |
| SCHEMBL24434619 | 0.71 | DRD2 (0.54) | KCNH2 |
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-109232540-A | A kind of substituted benzimidazole derivative and application | 深圳市坤健创新药物研究院 | 2019-01-18 | — | — | CN | disclosed |