Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 5/20 | 0.41 |
| ▸ | RAB9A | P51151 | 5/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.39 |
| ▸ | APEX1 | P27695 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.36 |
| ▸ | TNF | P01375 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6233523 | 0.92 | NPC1 (0.41) | NPC1RAB9AALDH1A1CYP2D6MAPK1 | |
| SCHEMBL7857400 | 0.91 | NPC1 (0.41) | NPC1RAB9AALDH1A1CYP2D6KDM4E | |
| SCHEMBL10192707 | 0.91 | NPC1 (0.41) | NPC1RAB9AALDH1A1CYP2D6KDM4E | |
| SCHEMBL2169248 | 0.88 | KDM4E (0.48) | ALDH1A1CYP2D6KDM4ETP53GLA | |
| SCHEMBL7858314 | 0.88 | KDM4E (0.48) | ALDH1A1CYP2D6KDM4ETP53GLA | |
| SCHEMBL7861210 | 0.88 | KDM4E (0.48) | ALDH1A1CYP2D6KDM4ETP53GLA | |
| SCHEMBL7673559 | 0.87 | TDP1 (0.40) | NPC1RAB9AALDH1A1CYP2D6KDM4E | |
| SCHEMBL13258582 | 0.87 | NPC1 (0.41) | NPC1RAB9AALDH1A1CYP2D6KMT2A | |
| SCHEMBL7857231 | 0.86 | ALDH1A1 (0.41) | ALDH1A1CYP2D6KDM4ETP53GLA | |
| SCHEMBL7850416 | 0.86 | ALDH1A1 (0.41) | ALDH1A1CYP2D6KDM4ETP53GLA |
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-2010139266-A1 | METHODS FOR SYNTHESIZING 3-(SUBSTITUTED DIHYDROISOINDOLINONE-2-YL)-2,6-DIOXOPIPERIDINE, AND INTERMEDIATES THEREOF | Nanjing Cavendish Bio-Engineering Technology Co., Ltd. (CN) | 2010-12-09 | — | — | WO | disclosed |