Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FDPS | P14324 | 2/20 | 0.63 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | DAO | P14920 | 1/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | BRD4 | O60885 | 1/20 | 0.33 |
| ▸ | NOS3 | P29474 | 1/20 | 0.33 |
| ▸ | NOS1 | P29475 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | GLS | O94925 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| Phosphoric Acid SCHEMBL16758488 | 0.78 | FDPS (0.58) | FDPSHDAC1HDAC6TSHRTDP1 | |
| SCHEMBL10410288 | 0.78 | FDPS (1.00) | FDPSHDAC1HDAC6TSHRTDP1 | |
| SCHEMBL10408967 | 0.72 | FDPS (0.54) | FDPSHDAC1HDAC6CA12CA2 | |
| Water SCHEMBL10408870 | 0.71 | FDPS (0.53) | FDPSHDAC1HDAC6CA12CA2 | |
| Phosphonic Acid SCHEMBL10408871 | 0.70 | FDPS (0.61) | FDPSHDAC1HDAC6TSHRTDP1 | |
| SCHEMBL647572 | 0.69 | — | — | |
| SCHEMBL26165802 | 0.68 | — | — | |
| SCHEMBL27677685 | 0.68 | — | — | |
| SCHEMBL23701903 | 0.68 | HIF1A (0.47) | FDPSHDAC1HDAC6TSHRTDP1 | |
| SCHEMBL5713341 | 0.68 | DAO (0.50) | FDPSHDAC1HDAC6TSHRTDP1 |
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-107438603-A | Pyrazole compounds and methods of making and using the same | 里格尔药品股份有限公司 | 2017-12-05 | — | — | CN | disclosed |