Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 3/20 | 0.58 |
| ▸ | CTSL | P07711 | 2/20 | 0.58 |
| ▸ | EGFR | P00533 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | GAA | P10253 | 1/20 | 0.51 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.51 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.51 |
| ▸ | PARP1 | P09874 | 1/20 | 0.49 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.49 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.49 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL940532 | 0.83 | ALDH1A1 (0.67) | CTSKCTSLALDH1A1GAAALOX12 | |
| SCHEMBL22736822 | 0.77 | NPC1 (0.54) | ALDH1A1GAAPARP1PRSS1PRSS2 | |
| SCHEMBL22193568 | 0.77 | NPC1 (0.54) | PARP1PRSS1PRSS2PRSS3 | |
| SCHEMBL25455101 | 0.77 | NPC1 (0.54) | PARP1PRSS1PRSS2PRSS3 | |
| SCHEMBL21507541 | 0.77 | NPC1 (0.54) | PARP1PRSS1PRSS2PRSS3 | |
| SCHEMBL29500266 | 0.73 | PARP1 (0.67) | ALDH1A1PARP1PRSS1PRSS2PRSS3 | |
| SCHEMBL2888543 | 0.73 | PARP1 (0.67) | ALDH1A1PARP1PRSS1PRSS2PRSS3 | |
| SCHEMBL15366757 | 0.73 | CTSL (1.00) | CTSKCTSL | |
| SCHEMBL6232192 | 0.71 | CTSK (0.60) | CTSKCTSLEGFR | |
| SCHEMBL9123694 | 0.71 | CTSL (0.53) | CTSKCTSL |
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-2019125323-A3 | AGENT CONTAINING CU(II) COMPLEXES OF 2-HYDROXY-5 METOXYACETOPHENONE THIOSEMICARBAZONE AND 4(N)-ETHYL AND N(4)-PHENYL | PEHLIVANOGLU SURAY (TR) | 2019-08-29 | — | — | WO | disclosed |
| WO-2019125323-A2 | AGENT CONTAINING CU(II) COMPLEXES OF 2-HYDROXY-5 METOXYACETOPHENONE THIOSEMICARBAZONE AND 4(N)-ETHYL AND N(4)-PHENYL | PEHLIVANOGLU SURAY (TR) | 2019-06-27 | — | — | WO | disclosed |