Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOD1 | Q9Y239 | 1/20 | 0.42 |
| ▸ | TERT | O14746 | 1/20 | 0.42 |
| ▸ | ITGB3 | P05106 | 3/20 | 0.39 |
| ▸ | ITGB1 | P05556 | 3/20 | 0.39 |
| ▸ | ITGAV | P06756 | 3/20 | 0.39 |
| ▸ | ITGA5 | P08648 | 3/20 | 0.39 |
| ▸ | MDM2 | Q00987 | 2/20 | 0.39 |
| ▸ | MDM4 | O15151 | 2/20 | 0.39 |
| ▸ | ECE1 | P42892 | 1/20 | 0.39 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.38 |
| ▸ | ENPEP | Q07075 | 2/20 | 0.38 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.37 |
| ▸ | GSTK1 | Q9Y2Q3 | 1/20 | 0.37 |
| ▸ | OPRD1 | P41143 | 5/20 | 0.36 |
| ▸ | OPRM1 | P35372 | 4/20 | 0.36 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 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 | |
|---|---|---|---|---|
| SCHEMBL29496724 | 0.89 | CA2 (0.46) | NOD1TERTECE1ENPEPPTGS1 | |
| SCHEMBL13848500 | 0.86 | PTGS1 (0.40) | NOD1ITGB3ITGB1ITGAVITGA5 | |
| SCHEMBL5881138 | 0.83 | NOD1 (0.48) | NOD1ECE1ENPEP | |
| SCHEMBL30422914 | 0.81 | ITGB3 (0.39) | TERTITGB3ITGB1ITGAVITGA5 | |
| SCHEMBL29429287 | 0.81 | ECE1 (0.51) | NOD1TERTECE1PTGS1GSTK1 | |
| SCHEMBL7555588 | 0.78 | PTGS1 (0.46) | TERTECE1PTGS1GSTK1OPRD1 | |
| SCHEMBL7555590 | 0.78 | PTGS1 (0.46) | TERTECE1PTGS1GSTK1OPRD1 | |
| SCHEMBL29351781 | 0.78 | MME (0.47) | NOD1TERTPTGS1GSTK1OPRD1 | |
| SCHEMBL32690536 | 0.77 | KEAP1 (0.39) | ITGB3ITGB1ITGAVITGA5MDM2 | |
| SCHEMBL30952095 | 0.77 | PTGS1 (0.39) | NOD1PTGS1GSTK1OPRD1OPRM1 |
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 |
|---|---|---|---|---|---|---|---|
| US-20140219926-A1 | Biodegradable Iron Oxide Nanoparticle Gel for Tumor Bed Therapy | THE TRUSTEES OF DARTMOUTH COLLEGE (US) | 2014-08-07 | — | — | US | disclosed |