Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | PKM | P14618 | 1/20 | 0.31 |
| ▸ | PKLR | P30613 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.31 |
| ▸ | GFER | P55789 | 1/20 | 0.30 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL13963492 | 0.71 | PKM (0.40) | ALDH1A1TSHRPKMPKLRRAB9A | |
| SCHEMBL474786 | 0.67 | KDM4E (0.37) | ALDH1A1MAPTPKMRAB9AKDM4E | |
| SCHEMBL25080112 | 0.67 | ALDH1A1 (0.39) | ALDH1A1USP2HPGDTSHRMEN1 | |
| SCHEMBL18876288 | 0.65 | ALDH2 (0.35) | TSHRKMT2AKDM4E | |
| SCHEMBL25080105 | 0.64 | KMT2A (0.46) | ALDH1A1USP2HPGDTSHRMAPT | |
| SCHEMBL8343119 | 0.64 | ADORA2B (0.43) | ALDH1A1HPGDTSHRMAPT | |
| SCHEMBL8344117 | 0.64 | MAPT (0.45) | ALDH1A1HPGDMAPTKMT2ARAB9A | |
| SCHEMBL18876406 | 0.63 | KDM4E (0.34) | MAPTKDM4E | |
| SCHEMBL8313169 | 0.62 | AAK1 (0.33) | ALDH1A1HPGD | |
| SCHEMBL8343898 | 0.62 | KAT2B (0.35) | ALDH1A1HPGDHSD17B10 |
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-2004014384-A2 | CYCLIC COMPOUNDS CONTAINING ZINC BINDING GROUPS AS MATRIX METALLOPROTEINASE INHIBITORS | WARNER-LAMBERT COMPANY LLC (US) | 2004-02-19 | — | — | WO | disclosed |