Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 7/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | BAZ2B | Q9UIF8 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | CNR2 | P34972 | 1/20 | 0.43 |
| ▸ | CNR1 | P21554 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | USP2 | O75604 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | CASP1 | P29466 | 2/20 | 0.41 |
| ▸ | CASP7 | P55210 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.40 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.39 |
| ▸ | HTR1A | P08908 | 1/20 | 0.39 |
| ▸ | DRD2 | P14416 | 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 | |
|---|---|---|---|---|
| SCHEMBL970353 | 0.89 | PARP1 (0.52) | PARP1ALDH1A1KDM4EHPGDBAZ2B | |
| SCHEMBL967959 | 0.89 | USP2 (0.54) | PARP1ALDH1A1KDM4EHPGDBAZ2B | |
| SCHEMBL967791 | 0.89 | NPC1 (0.58) | PARP1ALDH1A1KDM4EHPGDBAZ2B | |
| SCHEMBL970324 | 0.86 | ALDH1A1 (0.64) | PARP1ALDH1A1KDM4EHPGDMEN1 | |
| SCHEMBL968649 | 0.86 | PARP1 (0.50) | PARP1ALDH1A1KDM4EHPGDNPC1 | |
| SCHEMBL967938 | 0.86 | HDAC1 (0.54) | PARP1ALDH1A1KDM4EHPGDBAZ2B | |
| SCHEMBL969089 | 0.85 | PARP1 (0.65) | PARP1ALDH1A1KDM4EHPGDMEN1 | |
| SCHEMBL13985932 | 0.85 | PARP1 (0.49) | PARP1ALDH1A1KDM4EHPGDNPC1 | |
| SCHEMBL968434 | 0.84 | ALDH1A1 (0.64) | PARP1ALDH1A1KDM4EHPGDMEN1 | |
| SCHEMBL968632 | 0.84 | PARP1 (0.48) | PARP1ALDH1A1KDM4EHPGDNPC1 |
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-2009003003-A2 | PIPERAZINYL OXOALKYL TETRAHYDRO-BETA-CARBOLINES AND RELATED ANALOGUES | NEUROGEN CORPORATION (US) | 2008-12-31 | — | — | WO | disclosed |