Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 3/20 | 0.34 |
| ▸ | ERBB2 | P04626 | 3/20 | 0.34 |
| ▸ | MAOA | P21397 | 1/20 | 0.34 |
| ▸ | BCHE | P06276 | 4/20 | 0.33 |
| ▸ | ACHE | P22303 | 3/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | SLC2A1 | P11166 | 4/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | PDE4A | P27815 | 2/20 | 0.32 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.32 |
| ▸ | PDE4C | Q08493 | 2/20 | 0.32 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | RECQL | P46063 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL18116075 | 0.94 | MAOA (0.35) | EGFRERBB2MAOALMNARAB9A | |
| SCHEMBL18116047 | 0.81 | MAOA (0.36) | MAOALMNARAB9AHPGDKDM4E | |
| SCHEMBL22536765 | 0.74 | NCEH1 (0.36) | EGFRERBB2SLC2A1KDM4EPDE4A | |
| SCHEMBL29880175 | 0.72 | SLC2A1 (0.34) | SLC2A1KDM4ERECQL | |
| SCHEMBL22536823 | 0.72 | SLC2A1 (0.34) | SLC2A1KDM4ERECQL | |
| SCHEMBL22536766 | 0.72 | NCEH1 (0.33) | MAOALMNASLC2A1KDM4EPDE4A | |
| SCHEMBL18116056 | 0.70 | BACE1 (0.35) | EGFRERBB2LMNASLC2A1KDM4E | |
| SCHEMBL18116077 | 0.69 | KDM4E (0.33) | LMNAKDM4EPDE4APDE4BPDE4C | |
| SCHEMBL22536768 | 0.65 | NCEH1 (0.34) | BCHEACHESLC2A1KDM4ERECQL | |
| SCHEMBL29879820 | 0.63 | ACHE (0.32) | BCHEACHESLC2A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3274346-A1 | WATER-SOLUBLE PRODRUGS | Boston Biomedical, Inc. (US) | 2018-01-31 | — | — | EP | disclosed |
| WO-2016157052-A1 | WATER-SOLUBLE PRODRUGS | BOSTON BIOMEDICAL, INC. (US) | 2016-10-06 | — | — | WO | disclosed |