Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | CASP1 | P29466 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | CASP7 | P55210 | 1/20 | 0.39 |
| ▸ | SMAD3 | P84022 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
| ▸ | DRD2 | P14416 | 1/20 | 0.36 |
| ▸ | DRD1 | P21728 | 1/20 | 0.36 |
| ▸ | DRD4 | P21917 | 1/20 | 0.36 |
| ▸ | DRD5 | P21918 | 1/20 | 0.36 |
| ▸ | ESR1 | P03372 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL29915622 | 0.95 | MEN1 (0.42) | MEN1ALDH1A1KMT2AKDM4ELMNA | |
| SCHEMBL111871 | 0.95 | MEN1 (0.42) | MEN1ALDH1A1KMT2AKDM4ELMNA | |
| SCHEMBL107921 | 0.92 | NOTUM (0.40) | MAOADRD2DRD1DRD4DRD5 | |
| SCHEMBL29803467 | 0.92 | NOTUM (0.40) | MAOADRD2DRD1DRD4DRD5 | |
| Bromide SCHEMBL9480957 | 0.90 | DRD2 (0.40) | KDM4EMAPTMAOADRD2DRD1 | |
| SCHEMBL29915678 | 0.85 | ACHE (0.39) | MEN1ALDH1A1KMT2AMAOADRD2 | |
| SCHEMBL110491 | 0.85 | ACHE (0.39) | MEN1ALDH1A1KMT2AMAOADRD2 | |
| Bromide SCHEMBL9480751 | 0.84 | DRD2 (0.40) | MEN1ALDH1A1KMT2AMAOADRD2 | |
| SCHEMBL1884804 | 0.83 | S1PR1 (0.41) | HTTMAOAACHE | |
| SCHEMBL14235439 | 0.80 | MEN1 (0.40) | MEN1ALDH1A1KMT2AKDM4ELMNA |
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-1797863-A1 | Combinations of dye precursors comprising a diaminopyrazole derivative, an m-aminophenol derivative and an m-phenylene diamine derivative | HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) | 2007-06-20 | — | — | EP | disclosed |