Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | HPGD | P15428 | 3/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 3/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | EPHX2 | P34913 | 4/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9511778 | 0.96 | — | — | |
| SCHEMBL11286557 | 0.87 | HSD17B10 (0.52) | ALDH1A1HPGDHSD17B10CYP2C9ALOX15 | |
| Ammonia Solution, Strong SCHEMBL11294492 | 0.84 | HSD17B10 (0.50) | ALDH1A1HPGDHSD17B10CYP2C9ALOX15 | |
| SCHEMBL7585615 | 0.83 | ALDH1A1 (0.41) | ALDH1A1HPGDHSD17B10CYP2C9ALOX15 | |
| SCHEMBL24778744 | 0.81 | ALDH1A1 (0.40) | ALDH1A1HPGDMEN1KMT2ARAB9A | |
| SCHEMBL21215054 | 0.79 | ALDH1A1 (0.41) | ALDH1A1HPGDHSD17B10CYP2C9ALOX15 | |
| SCHEMBL24393289 | 0.78 | TSHR (0.46) | ALDH1A1HPGDHSD17B10CYP2C9ALOX15 | |
| SCHEMBL1673621 | 0.74 | — | — | |
| SCHEMBL24244627 | 0.74 | — | — | |
| SCHEMBL19788456 | 0.74 | — | — |
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-2003014292-A2 | COMBINATORIAL LIBRARY OF BIFUNCTIONAL MOLECULES | TECHNION RESEARCH AND DEVELOPMENT FOUNDATION LTD. (IL) | 2003-02-20 | — | — | WO | disclosed |