Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | HPGD | P15428 | 3/20 | 0.49 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.49 |
| ▸ | ESR1 | P03372 | 1/20 | 0.49 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.49 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.49 |
| ▸ | HMGB1 | P09429 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | GGT1 | P19440 | 1/20 | 0.49 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.49 |
| ▸ | BLM | P54132 | 1/20 | 0.49 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | CASP3 | P42574 | 6/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL6634972 | 0.84 | KDM4E (0.54) | KDM4EHSD17B10ALDH1A1HPGDPTGS2 | |
| SCHEMBL22033199 | 0.81 | CASP3 (0.69) | KDM4EHSD17B10ALDH1A1HPGDCASP3 | |
| SCHEMBL189443 | 0.79 | PTGS2 (0.74) | KDM4EHSD17B10ALDH1A1HPGDPTGS2 | |
| SCHEMBL30641073 | 0.79 | KMT2A (0.51) | KDM4EHSD17B10ALDH1A1HPGDCYP2C9 | |
| SCHEMBL9686151 | 0.78 | CASP3 (0.51) | KDM4EHSD17B10ALDH1A1HPGDTDP1 | |
| SCHEMBL11612938 | 0.78 | KDM4E (0.49) | KDM4EHSD17B10ALDH1A1HPGDCASP3 | |
| Diphenylether SCHEMBL3762390 | 0.77 | MAOA (0.50) | KDM4EHSD17B10ALDH1A1HPGDCASP3 | |
| SCHEMBL5128860 | 0.76 | KDM4E (0.58) | KDM4EHSD17B10ALDH1A1HPGDCASP3 | |
| SCHEMBL8094145 | 0.74 | KDM4E (0.47) | KDM4EHSD17B10ALDH1A1HPGDPTGS2 | |
| SCHEMBL8094143 | 0.74 | KDM4E (0.47) | KDM4EHSD17B10ALDH1A1HPGDLMNA |
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-0817643-A4 | COMPOUNDS AND COMPOSITIONS FOR DELIVERING ACTIVE AGENTS | EMISPHERE TECH INC (US) | 2004-10-06 | — | — | EP | disclosed |
| EP-0817643-A1 | COMPOUNDS AND COMPOSITIONS FOR DELIVERING ACTIVE AGENTS | Emisphere Technologies, Inc. (US) | 1998-01-14 | — | — | EP | disclosed |