Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.37 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.37 |
| ▸ | CASP3 | P42574 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.37 |
| ▸ | RELA | Q04206 | 1/20 | 0.37 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.37 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.37 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL26972864 | 0.84 | ALDH1A1 (0.36) | EGFRALDH1A1NPC1PLA2G1BNFKB1 | |
| SCHEMBL22425640 | 0.83 | ALDH1A1 (0.35) | EGFRALDH1A1NPC1PLA2G1BNFKB1 | |
| SCHEMBL7624892 | 0.81 | ALDH1A1 (0.41) | EGFRALDH1A1NPC1PLA2G1BNFKB1 | |
| SCHEMBL6129736 | 0.80 | ALDH1A1 (0.37) | EGFRALDH1A1NPC1PLA2G1BNFKB1 | |
| SCHEMBL17308142 | 0.79 | MAPT (0.40) | EGFRALDH1A1NPC1PLA2G1BNFKB1 | |
| SCHEMBL2934766 | 0.78 | ALDH1A1 (0.41) | EGFRALDH1A1NPC1PLA2G1BNFKB1 | |
| SCHEMBL7937338 | 0.78 | ALDH1A1 (0.39) | EGFRALDH1A1NPC1PLA2G1BNFKB1 | |
| SCHEMBL27922545 | 0.78 | ALDH1A1 (0.39) | EGFRALDH1A1NPC1PLA2G1BNFKB1 | |
| SCHEMBL23567967 | 0.78 | EGFR (0.37) | EGFRALDH1A1NPC1PLA2G1BNFKB1 | |
| SCHEMBL17308140 | 0.78 | CYP2C19 (0.38) | EGFRALDH1A1NPC1PLA2G1BNFKB1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021127461-A1 | METHODS OF SYNTHESIZING 4-VALYLOXYBUTYRIC ACID | XW LABORATORIES LIMITED (CN) | 2021-06-24 | — | — | WO | disclosed |