Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | ACHE | P22303 | 10/20 | 0.41 |
| ▸ | BACE1 | P56817 | 10/20 | 0.41 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.40 |
| ▸ | PTGIR | P43119 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | CRHBP | P24387 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.35 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.35 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.35 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.35 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL11100991 | 0.85 | MEN1 (0.50) | MEN1KMT2AACHEBACE1PTGIR | |
| SCHEMBL11096806 | 0.83 | MEN1 (0.44) | MEN1KMT2AACHEBACE1PTGIR | |
| SCHEMBL11098924 | 0.75 | KMT2A (0.54) | MEN1KMT2AACHEBACE1 | |
| Metrazifone SCHEMBL2108915 | 0.74 | NPC1 (0.43) | MEN1KMT2AKDM4ETSHRHSD17B10 | |
| SCHEMBL11092723 | 0.71 | ALPL (0.43) | MEN1KMT2AACHEBACE1 | |
| SCHEMBL11096866 | 0.71 | KDM5B (0.39) | MEN1KMT2AKDM4EHSD17B10PTGDR2 | |
| SCHEMBL9770984 | 0.69 | PTGIR (0.64) | MEN1KMT2AACHEBACE1PTGIR | |
| SCHEMBL9770992 | 0.69 | PTGIR (0.64) | MEN1KMT2AACHEBACE1PTGIR | |
| SCHEMBL9770961 | 0.68 | KMT2A (0.57) | MEN1KMT2AACHEBACE1PTGIR | |
| SCHEMBL5702986 | 0.66 | ALDH1A1 (0.55) | MEN1KMT2ATSHRHSD17B10NPC1 |
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-0036357-B1 | ANTALGIC AND ANTIAGREGANT CETONIC DERIVATIVES OF 5,6-DIARYL-1,2,4-TRIAZINES, USABLE IN THE TREATMENT OF MIGRAINE | PIERRE FABRE S.A. (FR) | 1984-05-30 | — | — | EP | claimed |