Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 1/20 | 0.56 |
| ▸ | AHR | P35869 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.35 |
| ▸ | TYMS | P04818 | 3/20 | 0.33 |
| ▸ | CASP3 | P42574 | 1/20 | 0.33 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.33 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | BRD4 | O60885 | 1/20 | 0.33 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.33 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.33 |
| ▸ | RHEB | Q15382 | 1/20 | 0.33 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.32 |
| ▸ | CSNK2B | P67870 | 1/20 | 0.31 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.31 |
| ▸ | DAO | P14920 | 1/20 | 0.31 |
| ▸ | GSK3B | P49841 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL29941319 | 0.72 | PARP1 (1.00) | PARP1AHRTDP1CHEK1GSK3B | |
| SCHEMBL24165623 | 0.70 | ALOX15 (0.37) | PARP1ALOX15TDP1TYMSCHEK1 | |
| SCHEMBL8121267 | 0.68 | DPP4 (0.42) | PARP1ALOX15TDP1BRD4MAPK14 | |
| SCHEMBL2398840 | 0.67 | AHR (0.52) | PARP1AHRALOX15PIK3CDMAPK1 | |
| SCHEMBL29423627 | 0.67 | DNMT1 (0.55) | ALOX15TDP1TYMSMAPK1 | |
| SCHEMBL137604 | 0.67 | DNMT1 (0.55) | ALOX15TDP1TYMSMAPK1 | |
| SCHEMBL6214537 | 0.67 | PARP1 (0.62) | PARP1MAPK1CHEK1GSK3B | |
| SCHEMBL4963574 | 0.67 | TYMS (0.41) | ALOX15TDP1TYMSMAPK1 | |
| SCHEMBL7094805 | 0.65 | GPR84 (0.45) | AHRALOX15TDP1CASP3SENP7 | |
| SCHEMBL29262283 | 0.65 | DNMT1 (0.53) | ALOX15TDP1TYMSMAPK1 |
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-101500563-B | Cycloalkanopyrolocarbazole derivatives and the use thereof as PARP, VEGFR2 and MLK3 inhibitors | CEPHALON INC | 2015-05-06 | — | — | CN | disclosed |