Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 5/20 | 0.58 |
| ▸ | AR | P10275 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | AXL | P30530 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | TNKS | O95271 | 3/20 | 0.39 |
| ▸ | TNKS2 | Q9H2K2 | 3/20 | 0.39 |
| ▸ | PARP2 | Q9UGN5 | 2/20 | 0.39 |
| ▸ | NOTUM | Q6P988 | 3/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | NCF1 | P14598 | 1/20 | 0.37 |
| ▸ | KIF11 | P52732 | 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 | |
|---|---|---|---|---|
| SCHEMBL1841757 | 0.77 | PARP1 (0.54) | PARP1ARTNKSTNKS2PARP2 | |
| SCHEMBL1845203 | 0.77 | PARP1 (0.54) | PARP1ARHSD17B10ALDH1A1TNKS | |
| SCHEMBL23301967 | 0.75 | CACNA1H (0.37) | PARP1 | |
| SCHEMBL29656854 | 0.75 | CACNA1H (0.37) | PARP1 | |
| SCHEMBL8022804 | 0.75 | AXL (0.49) | PARP1AXLALDH1A1MEN1POLB | |
| SCHEMBL1843209 | 0.74 | PARP1 (0.54) | PARP1ARTNKSTNKS2 | |
| SCHEMBL17950598 | 0.74 | PARP1 (0.42) | PARP1KDM4EHSD17B10AXLALDH1A1 | |
| SCHEMBL1094731 | 0.73 | PARP1 (1.00) | PARP1KDM4ESMN1; SMN2HSD17B10ALDH1A1 | |
| SCHEMBL873985 | 0.73 | TNKS (0.51) | PARP1ARKDM4EHSD17B10ALDH1A1 | |
| SCHEMBL3507122 | 0.72 | PARP1 (0.66) | PARP1KDM4ESMN1; SMN2ALDH1A1HPGD |
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-2015150366-A1 | CYCLICALLY SUBSTITUTED PHENOL ETHER DERIVATIVES AND USE THEREOF | BAYER PHARMA AKTIENGESELLSCHAFT (DE) | 2015-10-08 | — | — | WO | disclosed |