Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX15 | P16050 | 2/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 5/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.38 |
| ▸ | MEN1 | O00255 | 3/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | TSHR | P16473 | 3/20 | 0.38 |
| ▸ | ABCB11 | O95342 | 3/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.38 |
| ▸ | NR1I2 | O75469 | 2/20 | 0.38 |
| ▸ | NR3C1 | P04150 | 2/20 | 0.38 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.38 |
| ▸ | TBXA2R | P21731 | 2/20 | 0.38 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8082470 | 0.85 | ALOX15 (0.51) | ALOX15CYP2C9CYP1A2CYP3A4CYP2C19 | |
| SCHEMBL9045340 | 0.80 | PYGL (0.36) | ALOX15CYP2C9CYP1A2CYP3A4CYP2C19 | |
| SCHEMBL9048171 | 0.77 | HSD17B10 (0.49) | ALOX15MEN1KMT2AKDM4ETSHR | |
| SCHEMBL8805027 | 0.74 | CACNA1F (0.40) | MEN1KMT2AKDM4ETSHRNPSR1 | |
| SCHEMBL7263830 | 0.74 | CYP2C9 (0.39) | ALOX15CYP2C9CYP1A2CYP3A4CYP2C19 | |
| SCHEMBL7270629 | 0.74 | CYP2C9 (0.39) | ALOX15CYP2C9CYP1A2CYP3A4CYP2C19 | |
| SCHEMBL10787092 | 0.73 | KDM4E (0.58) | ALOX15CYP2C9CYP1A2CYP3A4CYP2C19 | |
| SCHEMBL9689545 | 0.73 | ALDH1A1 (0.52) | CYP2C9CYP1A2CYP3A4CYP2C19MEN1 | |
| Hydrochloric Acid SCHEMBL10379396 | 0.71 | ALOX15 (0.47) | ALOX15KDM4ETSHRHSD17B10ALDH1A1 | |
| SCHEMBL9691243 | 0.71 | ALDH1A1 (0.46) | ALOX15CYP2C9CYP1A2CYP3A4CYP2C19 |
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-0705830-A1 | 2,3-Cyclic condensed 1,4-dihydropyridines, process for their preparation and their use as K-channel modulators | BAYER AG (DE) | 1996-04-10 | — | — | EP | disclosed |