Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 1/20 | 0.57 |
| ▸ | FEN1 | P39748 | 4/20 | 0.49 |
| ▸ | ALOX5AP | P20292 | 3/20 | 0.49 |
| ▸ | MPL | P40238 | 1/20 | 0.47 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.46 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | PTPRC | P08575 | 1/20 | 0.43 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.43 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.42 |
| ▸ | MPO | P05164 | 1/20 | 0.41 |
| ▸ | C1R | P00736 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL16506354 | 0.79 | XIAP (0.53) | BACE1FEN1ALOX5APMPLMAP4K4 | |
| SCHEMBL28116695 | 0.79 | PTPRC (0.54) | BACE1FEN1ALOX5APMAP4K4TRPA1 | |
| SCHEMBL1337677 | 0.78 | FEN1 (0.47) | BACE1FEN1ALOX5APMPLMAP4K4 | |
| SCHEMBL7702897 | 0.75 | BACE1 (0.57) | BACE1FEN1ALOX5APTRPA1KDM4E | |
| SCHEMBL7709062 | 0.75 | BACE1 (0.57) | BACE1FEN1ALOX5APTRPA1KDM4E | |
| SCHEMBL16151213 | 0.75 | ADORA2A (0.49) | BACE1MPLMAP4K4TRPA1ADORA2A | |
| SCHEMBL31047274 | 0.75 | ADORA2A (0.49) | BACE1MPLMAP4K4TRPA1ADORA2A | |
| SCHEMBL10730124 | 0.75 | ADORA2A (0.49) | BACE1TRPA1ADORA2ANPC1PTPRC | |
| SCHEMBL1337206 | 0.73 | BACE1 (0.44) | BACE1FEN1ALOX5APMPLMAP4K4 | |
| SCHEMBL7711628 | 0.73 | ALOX15 (0.49) | KDM4EALDH1A1MEN1NFKB1MAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6355653-B1 | DRUG AND CARRIER FOR ANTIALLERGENS, BRAIN DISORDERS AND NEUROTRANSMITTERS | HOFFMANN-LA ROCHE INC. | 2002-03-12 | — | — | US | disclosed |