Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.63 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.63 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.50 |
| ▸ | HPGD | P15428 | 3/20 | 0.50 |
| ▸ | POLB | P06746 | 2/20 | 0.50 |
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | CASP1 | P29466 | 1/20 | 0.50 |
| ▸ | CASP7 | P55210 | 1/20 | 0.50 |
| ▸ | BAP1 | Q92560 | 1/20 | 0.50 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 4/20 | 0.47 |
| ▸ | TBXA2R | P21731 | 3/20 | 0.46 |
| ▸ | ADRA1A | P35348 | 3/20 | 0.46 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.46 |
| ▸ | ABCB11 | O95342 | 3/20 | 0.46 |
| ▸ | HTR1A | P08908 | 2/20 | 0.46 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.46 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.46 |
| ▸ | DRD1 | P21728 | 2/20 | 0.46 |
| ▸ | SLC6A2 | P23975 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7379319 | 0.93 | ALDH1A1 (0.73) | ALDH1A1KDM4EHSD17B10HPGDPOLB | |
| SCHEMBL10829922 | 0.87 | KDM4E (0.62) | ALDH1A1KDM4EHSD17B10POLBTSHR | |
| SCHEMBL10652934 | 0.86 | ALDH1A1 (0.51) | ALDH1A1KDM4EHSD17B10HPGDPOLB | |
| SCHEMBL11003749 | 0.86 | ALDH1A1 (0.58) | ALDH1A1KDM4EHSD17B10HPGDPOLB | |
| SCHEMBL11008190 | 0.85 | KDM4E (0.67) | ALDH1A1KDM4EHSD17B10HPGDPOLB | |
| SCHEMBL11002475 | 0.84 | KDM4E (0.63) | ALDH1A1KDM4EHSD17B10HPGDPOLB | |
| SCHEMBL9637845 | 0.83 | ALDH1A1 (0.62) | ALDH1A1KDM4EHSD17B10HPGDPOLB | |
| SCHEMBL13333342 | 0.83 | ALDH1A1 (0.71) | ALDH1A1KDM4EHSD17B10HPGDPOLB | |
| SCHEMBL11007496 | 0.82 | KDM4E (0.67) | ALDH1A1KDM4EHSD17B10HPGDCASP1 | |
| SCHEMBL10730869 | 0.82 | KDM4E (0.76) | ALDH1A1KDM4EHSD17B10HPGDPOLB |
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-5026714-A | Novel 1-alkyl-substituted 1,4-dihydropyridinelactone anti-diabetics | BAYER AKTIENGESELLSCHAFT (DE) | 1991-06-25 | — | — | US | disclosed |