Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 3/20 | 0.53 |
| ▸ | PPARA | Q07869 | 2/20 | 0.49 |
| ▸ | PPARG | P37231 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.47 |
| ▸ | CFD | P00746 | 2/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | ESR1 | P03372 | 1/20 | 0.40 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.40 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.40 |
| ▸ | HMGB1 | P09429 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | GGT1 | P19440 | 1/20 | 0.40 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.40 |
| ▸ | BLM | P54132 | 1/20 | 0.40 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL6400514 | 0.84 | KDM4E (0.52) | PTGS2PPARAPPARGKDM4ECFD | |
| Benzene SCHEMBL16599421 | 0.83 | KDM4E (0.51) | PTGS2PPARAPPARGKDM4ECFD | |
| SCHEMBL29127649 | 0.80 | PPARA (0.75) | PPARAPPARGKDM4ECFDHSD17B10 | |
| SCHEMBL30846845 | 0.78 | CCR5 (0.49) | PTGS2KDM4ECFDALDH1A1TSHR | |
| SCHEMBL5605087 | 0.78 | CFD (0.56) | PTGS2KDM4ECFDHSD17B10ALDH1A1 | |
| SCHEMBL5267194 | 0.77 | PTGS2 (0.57) | PTGS2KDM4ECFDHSD17B10ALDH1A1 | |
| SCHEMBL27623501 | 0.75 | CFD (0.59) | PTGS2PPARAPPARGKDM4ECFD | |
| SCHEMBL16719152 | 0.74 | CFD (0.76) | PTGS2PPARAPPARGKDM4ECFD | |
| SCHEMBL3130804 | 0.74 | PTGS2 (0.53) | PTGS2PPARAPPARGKDM4EHSD17B10 | |
| SCHEMBL5266269 | 0.74 | PTGS2 (0.53) | PTGS2KDM4ECFDHSD17B10ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010035047-A1 | BINARY COMPOSITIONS COMPRISING AN NO-DONOR AND AN A-SMASE INHIBITOR FOR THE TREATMENT OF RESPIRATORY DISEASES | PHARMAPATENTS GLOBAL LTD. (GB) | 2010-04-01 | — | — | WO | claimed |
| WO-2010035047-A1 | BINARY COMPOSITIONS COMPRISING AN NO-DONOR AND AN A-SMASE INHIBITOR FOR THE TREATMENT OF RESPIRATORY DISEASES | PHARMAPATENTS GLOBAL LTD. (GB) | 2010-04-01 | — | — | WO | disclosed |