Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NUDT1 | P36639 | 1/20 | 0.52 |
| ▸ | NSD2 | O96028 | 1/20 | 0.49 |
| ▸ | PARP1 | P09874 | 1/20 | 0.49 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.48 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.48 |
| ▸ | TYRO3 | Q06418 | 1/20 | 0.48 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.48 |
| ▸ | PABPC1 | P11940 | 2/20 | 0.47 |
| ▸ | EIF4H | Q15056 | 2/20 | 0.47 |
| ▸ | CA12 | O43570 | 1/20 | 0.47 |
| ▸ | CA1 | P00915 | 1/20 | 0.47 |
| ▸ | CA2 | P00918 | 1/20 | 0.47 |
| ▸ | CA9 | Q16790 | 1/20 | 0.47 |
| ▸ | BCAT2 | O15382 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL30863578 | 1.00 | NUDT1 (0.52) | NUDT1NSD2PARP1PDE4BCSNK1A1 | |
| SCHEMBL27991327 | 0.92 | NUDT1 (0.61) | NUDT1CSNK1A1TYRO3DYRK1BBCAT2 | |
| SCHEMBL31032078 | 0.86 | PARP1 (0.47) | NSD2PARP1PDE4BPABPC1EIF4H | |
| SCHEMBL17559805 | 0.86 | NSD2 (0.54) | NSD2PABPC1EIF4HKDM4ESLC22A12 | |
| SCHEMBL1804352 | 0.85 | PARP1 (0.56) | NSD2PARP1PDE4BPABPC1EIF4H | |
| SCHEMBL8221166 | 0.85 | PARP1 (0.56) | NSD2PARP1PDE4BPABPC1EIF4H | |
| SCHEMBL30646218 | 0.83 | BCAT2 (0.63) | NUDT1PARP1CSNK1A1TYRO3DYRK1B | |
| SCHEMBL27872261 | 0.81 | NUDT1 (0.59) | NUDT1PARP1CSNK1A1TYRO3DYRK1B | |
| Quinoline SCHEMBL28140561 | 0.81 | PARP1 (0.57) | NSD2PARP1PDE4BPABPC1EIF4H | |
| SCHEMBL7502767 | 0.79 | NUDT1 (0.48) | NUDT1PARP1PDE4BKDM4ESLC22A12 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2011011514-A1 | HETEROARYL BENZAMIDES, COMPOSITIONS AND METHODS OF USE | THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) | 2011-01-27 | — | — | WO | claimed |
| CN-100393720-C | Cyclic benzimidazoles. | ALTANA PHARMA AG (DE) | 2008-06-11 | — | — | CN | claimed |
| WO-2011011514-A1 | HETEROARYL BENZAMIDES, COMPOSITIONS AND METHODS OF USE | THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) | 2011-01-27 | — | — | WO | disclosed |
| CN-100393720-C | Cyclic benzimidazoles. | ALTANA PHARMA AG (DE) | 2008-06-11 | — | — | CN | disclosed |
| CN-1764662-A | Cyclic benzimidazoles. | ALTANA PHARMA AG (DE) | 2006-04-26 | — | — | CN | disclosed |