Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | ATM | Q13315 | 2/20 | 0.49 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.47 |
| ▸ | PIM1 | P11309 | 1/20 | 0.43 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | PARP1 | P09874 | 2/20 | 0.41 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | BTK | Q06187 | 1/20 | 0.39 |
| ▸ | DHPS | P49366 | 1/20 | 0.39 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.39 |
| ▸ | TUBB | P07437 | 1/20 | 0.39 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.39 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.39 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.39 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL16114693 | 0.88 | ATM (0.50) | ALDH1A1ATMPDPK1PIM1PIM3 | |
| SCHEMBL46523 | 0.86 | ALDH1A1 (0.59) | ALDH1A1ATMPDPK1PARP1NUDT1 | |
| Hydrochloric Acid SCHEMBL16796081 | 0.84 | ALDH1A1 (0.58) | ALDH1A1ATMPDPK1PARP1NUDT1 | |
| SCHEMBL2521184 | 0.79 | PARP1 (0.58) | ALDH1A1ATMPDPK1KMT2APARP1 | |
| SCHEMBL6135290 | 0.78 | ATM (0.61) | ALDH1A1ATMPDPK1KMT2APARP1 | |
| SCHEMBL29822224 | 0.75 | NUDT1 (0.61) | ALDH1A1ATMPDPK1PARP1NUDT1 | |
| SCHEMBL9795027 | 0.75 | NUDT1 (0.61) | ALDH1A1ATMPDPK1PARP1NUDT1 | |
| SCHEMBL25668829 | 0.72 | ALDH1A1 (0.47) | ALDH1A1ATMPDPK1PARP1MAPK1 | |
| SCHEMBL634722 | 0.72 | ATM (0.55) | ALDH1A1ATMPDPK1KMT2APARP1 | |
| SCHEMBL30415690 | 0.72 | KDM4E (0.59) | ALDH1A1ATMKMT2APARP1KDM4E |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1809603-A4 | NITROBENZINDOLES AND THEIR USE IN CANCER THERAPY | AUCKLAND UNISERVICES LTD (NZ) | 2009-09-02 | — | — | EP | disclosed |
| EP-1809603-A1 | NITROBENZINDOLES AND THEIR USE IN CANCER THERAPY | Auckland Uniservices Limited (NZ) | 2007-07-25 | — | — | EP | disclosed |
| WO-2006043839-A1 | NITROBENZINDOLES AND THEIR USE IN CANCER THERAPY | AUCKLAND UNISERVICES LIMITED (NZ) | 2006-04-27 | — | — | WO | disclosed |