Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 7/20 | 0.45 |
| ▸ | ITGA2B | P08514 | 7/20 | 0.45 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.42 |
| ▸ | NAMPT | P43490 | 3/20 | 0.40 |
| ▸ | CYP46A1 | Q9Y6A2 | 1/20 | 0.40 |
| ▸ | F10 | P00742 | 5/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | CASP1 | P29466 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | F2 | P00734 | 1/20 | 0.38 |
| ▸ | PTGES | O14684 | 1/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL9409431 | 0.91 | ITGB3 (0.46) | ITGB3ITGA2BHDAC3HDAC1NAMPT | |
| SCHEMBL9409563 | 0.85 | ITGB3 (0.56) | ITGB3ITGA2BNAMPTCYP46A1F10 | |
| SCHEMBL9409403 | 0.81 | F10 (0.49) | F10LMNAMAPTF2 | |
| Hydrochloric Acid SCHEMBL9409480 | 0.77 | ITGB3 (0.61) | ITGB3ITGA2BNAMPTCYP46A1F10 | |
| SCHEMBL9409461 | 0.76 | DRD2 (0.48) | NAMPTCYP46A1F10LMNAGAA | |
| SCHEMBL7398105 | 0.73 | ACACB (0.49) | ITGB3ITGA2B | |
| Hydrochloric Acid SCHEMBL9409526 | 0.73 | F10 (0.47) | ITGB3ITGA2BF10LMNAMAPT | |
| Hydrochloric Acid SCHEMBL9409521 | 0.72 | DRD2 (0.53) | ITGB3ITGA2BNAMPTCYP46A1F10 | |
| SCHEMBL7399713 | 0.72 | ITGB3 (0.54) | ITGB3ITGA2B | |
| Hydrochloric Acid SCHEMBL9409542 | 0.68 | ITGB3 (0.44) | ITGB3ITGA2BHDAC3HDAC1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0604800-A1 | 4- 4- 4-(carboxyalkyl)-phenyl amino carbonyl -phenyl -piperedines as aggregation inhibitors | Dr. Karl Thomae GmbH (DE) | 1994-07-06 | — | — | EP | disclosed |