Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | GRIA2 | P42262 | 5/20 | 0.31 |
| ▸ | GRIA4 | P48058 | 5/20 | 0.31 |
| ▸ | GABRA1 | P14867 | 3/20 | 0.31 |
| ▸ | GABRB2 | P47870 | 3/20 | 0.31 |
| ▸ | CLCN2 | P51788 | 1/20 | 0.31 |
| ▸ | RXRA | P19793 | 1/20 | 0.31 |
| ▸ | RXRB | P28702 | 1/20 | 0.31 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.31 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.31 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.30 |
| ▸ | GABRP | O00591 | 2/20 | 0.30 |
| ▸ | GABRD | O14764 | 2/20 | 0.30 |
| ▸ | GABRB1 | P18505 | 2/20 | 0.30 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.30 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.30 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.30 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.30 |
| ▸ | GABRA2 | P47869 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL30704475 | 0.72 | ALDH1A1 (0.39) | ALDH1A1AKR1C3 | |
| SCHEMBL5829730 | 0.65 | RAPGEF4 (0.39) | ALDH1A1NPC1GABRA1GABRB2 | |
| SCHEMBL29920871 | 0.64 | MEN1 (0.33) | GABRA1GABRB2 | |
| SCHEMBL6119479 | 0.60 | SLC22A12 (0.42) | ALDH1A1NPC1RXRARXRB | |
| SCHEMBL13714044 | 0.60 | L3MBTL1 (0.41) | NPC1GABRA1GABRB2NR4A3GABRP | |
| SCHEMBL29631058 | 0.60 | NOTUM (0.40) | — | |
| SCHEMBL8876337 | 0.60 | ALDH1A1 (0.34) | ALDH1A1GABRA1GABRB2GABRPGABRD | |
| SCHEMBL6791488 | 0.59 | ALDH1A1 (0.31) | ALDH1A1 | |
| Bicarbonate SCHEMBL14635340 | 0.58 | GABRA1 (0.55) | ALDH1A1GABRA1GABRB2CLCN2 | |
| Bicarbonate SCHEMBL29051241 | 0.58 | GABRA1 (0.55) | ALDH1A1GABRA1GABRB2CLCN2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-100392108-C | Composition and use thereof | TFL LEDERTECHNIK GMBH (DE) | 2008-06-04 | — | — | CN | disclosed |
| CN-1625605-A | Composition and use thereof | TFL LEDERTECHNIK GMBH (DE) | 2005-06-08 | — | — | CN | disclosed |