Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LCK | P06239 | 1/20 | 0.38 |
| ▸ | PPARD | Q03181 | 1/20 | 0.38 |
| ▸ | ZDHHC20 | Q5W0Z9 | 1/20 | 0.38 |
| ▸ | ZDHHC2 | Q9UIJ5 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.36 |
| ▸ | GSR | P00390 | 1/20 | 0.36 |
| ▸ | ENPEP | Q07075 | 1/20 | 0.36 |
| ▸ | GPR84 | Q9NQS5 | 3/20 | 0.34 |
| ▸ | RNPEP | Q9H4A4 | 1/20 | 0.34 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | ARG1 | P05089 | 3/20 | 0.32 |
| ▸ | ARG2 | P78540 | 3/20 | 0.32 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.32 |
| ▸ | GSK3B | P49841 | 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 | |
|---|---|---|---|---|
| SCHEMBL27861319 | 0.97 | LCK (0.41) | LCKPPARDZDHHC20ZDHHC2ALDH1A1 | |
| SCHEMBL9697909 | 0.97 | LCK (0.41) | LCKPPARDZDHHC20ZDHHC2ALDH1A1 | |
| SCHEMBL19745135 | 0.97 | LCK (0.41) | LCKPPARDZDHHC20ZDHHC2ALDH1A1 | |
| SCHEMBL7931050 | 0.97 | LCK (0.41) | LCKPPARDZDHHC20ZDHHC2ALDH1A1 | |
| SCHEMBL27889470 | 0.92 | ALDH1A1 (0.39) | LCKPPARDZDHHC20ZDHHC2ALDH1A1 | |
| SCHEMBL12851496 | 0.85 | GSR (0.43) | LCKPPARDZDHHC20ZDHHC2TBXAS1 | |
| SCHEMBL30018402 | 0.82 | GPR84 (0.46) | LCKPPARDZDHHC20ZDHHC2TBXAS1 | |
| SCHEMBL3613866 | 0.82 | GPR84 (0.46) | LCKPPARDZDHHC20ZDHHC2TBXAS1 | |
| SCHEMBL21073899 | 0.82 | GPR84 (0.46) | LCKPPARDZDHHC20ZDHHC2TBXAS1 | |
| SCHEMBL9009694 | 0.82 | GPR84 (0.46) | LCKPPARDZDHHC20ZDHHC2TBXAS1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2020043144-A1 | PHOSPHATE OF PLATINUM COMPOUND AND PREPARATION METHOD THEREFOR | 北京硕佰医药科技有限责任公司 | 2020-03-05 | — | — | WO | disclosed |
| WO-2004076425-A1 | IMPROVED SYNTHESIS OF MACROCYCLIC TETRAAMIDO COMPOUNDS AND NEW METAL INSERTION PROCESS | CARNEGIE MELLON UNIVERSITY (US) | 2004-09-10 | — | — | WO | disclosed |