Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TOP2A | P11388 | 2/20 | 0.50 |
| ▸ | PARP1 | P09874 | 10/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.38 |
| ▸ | CFTR | P13569 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | PKN1 | Q16512 | 1/20 | 0.37 |
| ▸ | PKN2 | Q16513 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | CA5A | P35218 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7440762 | 0.94 | TOP2A (0.55) | TOP2ANPC1RAB9AKDM4EALDH1A1 | |
| SCHEMBL1387291 | 0.91 | PARP1 (0.46) | PARP1ALDH1A1 | |
| SCHEMBL19268309 | 0.80 | TSHR (0.47) | TOP2ANPC1RAB9AKDM4EALDH1A1 | |
| SCHEMBL4308379 | 0.78 | MAOB (0.46) | TOP2ANPC1RAB9AKDM4EALDH1A1 | |
| SCHEMBL22822215 | 0.78 | PLK1 (0.43) | TOP2AALDH1A1HPGDGAAHSD17B10 | |
| SCHEMBL1004337 | 0.77 | TOP2A (0.57) | TOP2ANPC1RAB9AKDM4EALDH1A1 | |
| SCHEMBL8664917 | 0.76 | TOP2A (0.64) | TOP2APARP1NPC1RAB9AKDM4E | |
| SCHEMBL19914241 | 0.76 | ALDH1A1 (0.48) | TOP2ANPC1RAB9AKDM4EALDH1A1 | |
| SCHEMBL1398896 | 0.76 | TOP2A (0.59) | TOP2ANPC1RAB9AKDM4EALDH1A1 | |
| SCHEMBL13999320 | 0.75 | PDK1 (0.39) | TOP2ANPC1RAB9AKDM4EALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0879820-A1 | Benzamide analogues, useful as PARP (ADP-Ribosyltransferase, ADPRT) DNA repair enzyme inhibitors | NEWCASTLE UNIVERSITY VENTURES LIMITED (GB) | 1998-11-25 | — | — | EP | disclosed |
| WO-1995024379-A1 | BENZAMIDE ANALOGS, USEFUL AS PARP (ADP-RIBOSYLTRANSFERASE, ADPRT) DNA REPAIR ENZYME INHIBITORS | NEWCASTLE UNIVERSITY VENTURES LIMITED (GB) | 1995-09-14 | — | — | WO | disclosed |