Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.54 |
| ▸ | MEN1 | O00255 | 2/20 | 0.54 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.54 |
| ▸ | GRM4 | Q14833 | 2/20 | 0.52 |
| ▸ | NPC1 | O15118 | 4/20 | 0.51 |
| ▸ | RAB9A | P51151 | 4/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.51 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.51 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | POLB | P06746 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 1/20 | 0.51 |
| ▸ | TP53 | P04637 | 2/20 | 0.50 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.50 |
| ▸ | RELA | Q04206 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL10821699 | 0.86 | ALDH1A1 (0.52) | ALDH1A1KMT2AMEN1L3MBTL1GRM4 | |
| SCHEMBL10821436 | 0.78 | ALDH1A1 (0.67) | ALDH1A1KMT2AMEN1L3MBTL1GRM4 | |
| Water SCHEMBL10821435 | 0.76 | ALDH1A1 (0.65) | ALDH1A1KMT2AMEN1L3MBTL1GRM4 | |
| SCHEMBL1077553 | 0.75 | NPC1 (0.53) | ALDH1A1KMT2AMEN1L3MBTL1NPC1 | |
| SCHEMBL4906352 | 0.74 | GRM4 (0.64) | ALDH1A1KMT2AMEN1L3MBTL1GRM4 | |
| SCHEMBL7900424 | 0.73 | ALDH1A1 (0.59) | ALDH1A1KMT2AMEN1L3MBTL1GRM4 | |
| SCHEMBL1080646 | 0.73 | RAB9A (0.59) | ALDH1A1KMT2ANPC1RAB9ASMN1; SMN2 | |
| SCHEMBL29516188 | 0.71 | GRM4 (0.68) | ALDH1A1KMT2AMEN1GRM4NPC1 | |
| SCHEMBL28501806 | 0.71 | GRM4 (0.68) | ALDH1A1KMT2AMEN1GRM4NPC1 | |
| SCHEMBL29086890 | 0.71 | ALDH1A1 (0.50) | ALDH1A1KMT2AMEN1L3MBTL1GRM4 |
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-2011005052-A2 | NOVEL ARYLPIPERAZINE-CONTAINING IMIDAZOLE 4-CARBOXAMIDE DERIVATIVES AND PHARMACEUTICAL COMPOSITION COMPRISING SAME | GREEN GROSS CORPORATION (KR) | 2011-01-13 | — | — | WO | disclosed |