Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.57 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 4/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.39 |
| ▸ | HPGD | P15428 | 3/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 2/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | SSTR4 | P31391 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL10366188 | 0.90 | ALDH1A1 (0.58) | ALDH1A1CYP3A4POLBKMT2ALMNA | |
| SCHEMBL10460171 | 0.89 | CYP3A4 (0.47) | ALDH1A1CYP3A4POLBKMT2AKDM4E | |
| SCHEMBL9633868 | 0.83 | ALDH1A1 (0.42) | ALDH1A1CYP3A4POLBKMT2AKDM4E | |
| SCHEMBL269849 | 0.82 | ALDH1A1 (0.66) | ALDH1A1CYP3A4POLBKMT2AKDM4E | |
| SCHEMBL10875656 | 0.82 | POLB (0.42) | ALDH1A1CYP3A4POLBKMT2AKDM4E | |
| SCHEMBL9663100 | 0.82 | POLB (0.42) | ALDH1A1CYP3A4POLBKMT2AKDM4E | |
| SCHEMBL10368324 | 0.81 | CYP3A4 (0.50) | ALDH1A1CYP3A4KMT2AKDM4ELMNA | |
| SCHEMBL6522972 | 0.81 | ALDH1A1 (0.50) | ALDH1A1CYP3A4KMT2AKDM4ELMNA | |
| SCHEMBL11347931 | 0.80 | POLB (0.44) | ALDH1A1CYP3A4POLBKMT2AKDM4E | |
| SCHEMBL10634281 | 0.80 | CYP3A4 (0.48) | ALDH1A1CYP3A4POLBKMT2ALMNA |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4897107-A | PLANT GROWTH REGULATORS; FUNGICIDES | BAYER AKTIENGESELLSCHAFT (DE) | 1990-01-30 | — | — | US | claimed |
| US-5141553-A | ETHER DERIVATIVES OF SUBSTITUTED 1-HYDROXYALKYL-AZOLES AS FUNGICIDES AND PLANT GROWTH REGULATORS | BAYER AKTIENGESELLSCHAFT (DE) | 1992-08-25 | — | — | US | disclosed |
| US-4868196-A | Ether derivatives of substituted 1-hydroxyalkyl- azoles as fungicides and plant growth regulators | BAYER AKTIENGESELLSCHAFT (DE) | 1989-09-19 | — | — | US | disclosed |
| EP-0085333-B1 | ETHER DERIVATIVES FROM SUBSTITUTED 1-HYDROXYALKYL AZOLES, PROCESS FOR THEIR PREPARATION AS WELL AS THEIR USE AS FUNGICIDES AND PLANT-GROWTH REGULATORS | BAYER AG (DE) | 1986-02-26 | — | — | EP | disclosed |
| EP-0085843-A1 | Antimycosic agent | BAYER AG (DE) | 1983-08-17 | — | — | EP | disclosed |
| EP-0085333-A2 | Ether derivatives from substituted 1-hydroxyalkyl azoles, process for their preparation as well as their use as fungicides and plant-growth regulators | BAYER AG (DE) | 1983-08-10 | — | — | EP | disclosed |