Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.45 |
| ▸ | MAPT | P10636 | 5/20 | 0.43 |
| ▸ | LIMK1 | P53667 | 3/20 | 0.40 |
| ▸ | IKBKB | O14920 | 3/20 | 0.40 |
| ▸ | CHUK | O15111 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.39 |
| ▸ | HPGD | P15428 | 4/20 | 0.39 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.38 |
| ▸ | NPC1 | O15118 | 3/20 | 0.38 |
| ▸ | RAB9A | P51151 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | STAT1 | P42224 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL4116375 | 0.78 | KDM4E (0.50) | ALDH1A1MAPTKDM4EHPGDHTT | |
| SCHEMBL1698022 | 0.77 | IKBKB (0.42) | ALDH1A1MAPTLIMK1IKBKBCHUK | |
| SCHEMBL1697873 | 0.74 | KDM4E (0.54) | ALDH1A1MAPTIKBKBKDM4EHPGD | |
| SCHEMBL9541069 | 0.72 | KDM4E (0.49) | ALDH1A1MAPTLIMK1IKBKBCHUK | |
| SCHEMBL9541089 | 0.69 | ALDH1A1 (0.51) | ALDH1A1MAPTLIMK1KDM4EHPGD | |
| SCHEMBL11700479 | 0.69 | ALDH1A1 (0.44) | ALDH1A1MAPTHPGDALOX15HSD17B10 | |
| SCHEMBL9540888 | 0.69 | CHRM4 (0.69) | ALDH1A1MAPTKDM4ETP53CHRM1 | |
| SCHEMBL9542427 | 0.68 | ALDH1A1 (0.53) | ALDH1A1MAPTIKBKBKDM4EHPGD | |
| SCHEMBL9540856 | 0.66 | TP53 (0.46) | ALDH1A1MAPTLIMK1IKBKBCHUK | |
| SCHEMBL28013552 | 0.65 | RBBP9 (0.51) | ALDH1A1MAPTHPGDALOX15HSD17B10 |
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-1993013664-A2 | BIHETEROCYCLIC FUNGICIDAL COMPOUNDS | SCHERING AGROCHEMICALS LIMITED (GB) | 1993-07-22 | — | — | WO | disclosed |