Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FDPS | P14324 | 10/20 | 0.42 |
| ▸ | GGPS1 | O95749 | 7/20 | 0.42 |
| ▸ | SMPD1 | P17405 | 1/20 | 0.38 |
| ▸ | CES2 | O00748 | 1/20 | 0.36 |
| ▸ | LPAR1 | Q92633 | 1/20 | 0.36 |
| ▸ | LPAR3 | Q9UBY5 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL22263433 | 0.86 | TSHR (0.40) | FDPSGGPS1 | |
| SCHEMBL2842125 | 0.84 | TSHR (0.38) | FDPSGGPS1CES2LPAR1LPAR3 | |
| SCHEMBL20137187 | 0.79 | FDPS (0.43) | FDPSGGPS1SMPD1 | |
| SCHEMBL20137246 | 0.79 | FDPS (0.43) | FDPSGGPS1SMPD1 | |
| SCHEMBL27721720 | 0.79 | FDPS (0.43) | FDPSGGPS1SMPD1CES2 | |
| SCHEMBL28521973 | 0.78 | TSHR (0.42) | FDPSGGPS1SMPD1CES2LPAR1 | |
| SCHEMBL21179492 | 0.78 | TSHR (0.42) | FDPSGGPS1SMPD1CES2LPAR1 | |
| SCHEMBL18722279 | 0.78 | TSHR (0.42) | FDPSGGPS1SMPD1CES2LPAR1 | |
| SCHEMBL28460650 | 0.78 | TSHR (0.42) | FDPSGGPS1SMPD1CES2LPAR1 | |
| Water SCHEMBL11076441 | 0.77 | FDPS (0.42) | FDPSGGPS1SMPD1CES2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008059014-A2 | ANTITUBERCULOSIS AGENTS WITH ALKYLIDENE OR ALKYL SIDE CHAIN | UNIVERSIDAD DE SALAMANCA (ES) | 2008-05-22 | — | — | WO | disclosed |