Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP3 | P42574 | 2/20 | 0.41 |
| ▸ | SENP7 | Q9BQF6 | 2/20 | 0.41 |
| ▸ | SENP6 | Q9GZR1 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | KMO | O15229 | 1/20 | 0.33 |
| ▸ | ADCY8 | P40145 | 1/20 | 0.33 |
| ▸ | ADCY1 | Q08828 | 1/20 | 0.33 |
| ▸ | ADORA3 | P0DMS8 | 4/20 | 0.33 |
| ▸ | ADORA1 | P30542 | 4/20 | 0.33 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.33 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.33 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.32 |
| ▸ | NR5A2 | O00482 | 1/20 | 0.31 |
| ▸ | NR5A1 | Q13285 | 1/20 | 0.31 |
| ▸ | CEL | P19835 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL1777152 | 0.80 | CEL (0.38) | CASP3SENP7SENP6POLBTDP1 | |
| SCHEMBL7949502 | 0.79 | POLB (0.30) | CASP3SENP7SENP6POLB | |
| SCHEMBL21777712 | 0.78 | CEL (0.36) | CASP3SENP7SENP6POLBKMO | |
| SCHEMBL17710524 | 0.74 | CEL (0.32) | KMOCEL | |
| SCHEMBL28476729 | 0.72 | CEL (0.33) | CASP3SENP7SENP6POLBNPY5R | |
| SCHEMBL1776322 | 0.72 | CEL (0.33) | CASP3SENP7SENP6POLBNPY5R | |
| SCHEMBL27960979 | 0.72 | ABCB1 (0.34) | CASP3SENP7SENP6POLBKMO | |
| SCHEMBL379055 | 0.71 | ALDH1A1 (0.47) | TDP1ALDH1A1 | |
| SCHEMBL4886658 | 0.69 | CEL (0.32) | CASP3SENP7SENP6KMOCEL | |
| SCHEMBL1778508 | 0.69 | CEL (0.32) | KMOCEL |
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 |
|---|---|---|---|---|---|---|---|
| CN-102532030-A | Synthesis method for multi-substituted 2-imidoimidazoline-4,5-diketone | UNIV BEIJING | 2012-07-04 | — | — | CN | disclosed |
| US-6929872-B2 | Organic electroluminescent devices | NIPPON STEEL CHEMICAL CO., LTD. (JP) | 2005-08-16 | — | — | US | disclosed |
| US-20040028944-A1 | Organic electroluminescent devices | NIPPON STEEL & SUMIKIN CHEMICAL CO., LTD. (JP) | 2004-02-12 | — | — | US | disclosed |