Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 3/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 3/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | DRD2 | P14416 | 1/20 | 0.41 |
| ▸ | DRD4 | P21917 | 1/20 | 0.41 |
| ▸ | DRD3 | P35462 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | HTR1A | P08908 | 2/20 | 0.39 |
| ▸ | HTR7 | P34969 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.36 |
| ▸ | ADRA1A | P35348 | 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 | |
|---|---|---|---|---|
| SCHEMBL3861777 | 0.77 | ALDH1A1 (0.59) | MEN1KMT2APKMALDH1A1KDM4E | |
| SCHEMBL12204779 | 0.70 | ALDH1A1 (0.61) | MEN1KMT2APKMALDH1A1KDM4E | |
| SCHEMBL10919686 | 0.70 | HTR1B (0.62) | MEN1KMT2APKMKDM4ETSHR | |
| Hydrochloric Acid SCHEMBL10924447 | 0.68 | HTR1B (0.60) | MEN1KMT2APKMKDM4ETSHR | |
| SCHEMBL6949179 | 0.67 | MEN1 (0.62) | MEN1KMT2APKMALDH1A1KDM4E | |
| SCHEMBL30740944 | 0.65 | DRD2 (0.64) | MEN1KMT2APKMTSHRRAB9A | |
| SCHEMBL9808263 | 0.65 | L3MBTL1 (0.68) | MEN1KMT2APKMALDH1A1TSHR | |
| SCHEMBL5739036 | 0.64 | DRD2 (0.71) | MEN1KMT2APKMALDH1A1KDM4E | |
| SCHEMBL5824396 | 0.63 | L3MBTL1 (0.56) | MEN1KMT2APKMALDH1A1TSHR | |
| SCHEMBL14463854 | 0.63 | DRD2 (0.69) | MEN1KMT2APKMALDH1A1KDM4E |
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-0244641-B1 | 1,4-CYCLOHEXANE DIAMINES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS FUNGICIDES | BASF Aktiengesellschaft (DE) | 1991-08-21 | — | — | EP | disclosed |