Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 8/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | PARG | Q86W56 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | GLA | P06280 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | PIM1 | P11309 | 1/20 | 0.37 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.37 |
| ▸ | TNKS2 | Q9H2K2 | 2/20 | 0.37 |
| ▸ | TYMS | P04818 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL19992165 | 0.78 | PARP1 (0.57) | PARP1KDM4ECYP1A2CYP2D6CYP2C9 | |
| SCHEMBL527607 | 0.76 | CA12 (0.44) | PARP1KDM4ECYP1A2CYP2D6CYP2C9 | |
| SCHEMBL25112470 | 0.75 | PARP1 (0.54) | PARP1KDM4ECYP1A2CYP2D6CYP2C9 | |
| SCHEMBL526063 | 0.75 | PARP1 (0.54) | PARP1KDM4ECYP1A2CYP2D6CYP2C9 | |
| SCHEMBL29991941 | 0.75 | PARG (0.61) | PARP1KDM4EPARGNPC1ALDH1A1 | |
| SCHEMBL527853 | 0.75 | IP6K1 (0.51) | PARP1ALDH1A1PIM1PIM2IP6K1 | |
| SCHEMBL29991873 | 0.72 | KDM4E (0.50) | PARP1KDM4EPARGNPC1ALDH1A1 | |
| SCHEMBL525453 | 0.72 | PARP1 (0.50) | PARP1KDM4ECYP1A2CYP2D6CYP2C9 | |
| SCHEMBL527342 | 0.71 | PGR (0.34) | PARP1KDM4EPARGALDH1A1MAPT | |
| SCHEMBL526074 | 0.70 | PARP1 (0.70) | PARP1KDM4ECYP1A2CYP2D6CYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012014109-A1 | HETEROCYCLIC SULFONAMIDES AS INHIBITORS OF TRANSFER RNA SYNTHETASE FOR USE AS ANTIBACTERIAL AGENTS | RANBAXY LABORATORIES LIMITED (IN) | 2012-02-02 | — | — | WO | disclosed |