Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.50 |
| ▸ | CA1 | P00915 | 1/20 | 0.50 |
| ▸ | CA2 | P00918 | 1/20 | 0.50 |
| ▸ | CA9 | Q16790 | 1/20 | 0.50 |
| ▸ | HTR6 | P50406 | 2/20 | 0.46 |
| ▸ | DRD2 | P14416 | 3/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | NAMPT | P43490 | 2/20 | 0.39 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.39 |
| ▸ | DRD4 | P21917 | 1/20 | 0.38 |
| ▸ | DRD3 | P35462 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | THRB | P10828 | 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 | |
|---|---|---|---|---|
| SCHEMBL28150003 | 0.99 | CA12 (0.51) | CA12CA1CA2CA9HTR6 | |
| SCHEMBL28150046 | 0.88 | CA12 (0.56) | CA12CA1CA2CA9HTR6 | |
| SCHEMBL159804 | 0.81 | CYP11B1 (0.47) | HTR6 | |
| SCHEMBL27923228 | 0.80 | CA12 (0.65) | CA12CA1CA2CA9HTR6 | |
| SCHEMBL164101 | 0.80 | CYP11B1 (0.47) | HTR6MAPT | |
| SCHEMBL28150078 | 0.77 | KAT7 (0.54) | CA12CA1CA2CA9HTT | |
| SCHEMBL22446082 | 0.77 | CA12 (0.52) | CA12CA1CA2CA9HDAC1 | |
| SCHEMBL28150053 | 0.74 | NAMPT (0.51) | CA12CA1CA2CA9HDAC1 | |
| SCHEMBL23457079 | 0.74 | HTR6 (0.66) | HTR6DRD2MAPTGAAPIK3CA | |
| SCHEMBL28148733 | 0.73 | NAMPT (0.57) | HDAC1HDAC6HTTGAANAMPT |
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-103384668-B | compounds and compositions for inhibition of NAMPT | 福马TM有限责任公司 | 2017-05-31 | — | — | CN | claimed |