Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | GPBAR1 | Q8TDU6 | 5/20 | 0.46 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.42 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.42 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | TGM2 | P21980 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 5/20 | 0.39 |
| ▸ | NPC1 | O15118 | 4/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.39 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.39 |
| ▸ | RELA | Q04206 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL14743756 | 0.88 | GPBAR1 (0.46) | GPBAR1L3MBTL1 | |
| SCHEMBL14743805 | 0.88 | GPBAR1 (0.43) | ALDH1A1GPBAR1HSD17B10L3MBTL1RAB9A | |
| SCHEMBL14743979 | 0.87 | TSHR (0.42) | ALDH1A1GPBAR1L3MBTL1RAB9ANPC1 | |
| SCHEMBL14743641 | 0.85 | RAB9A (0.45) | GPBAR1HSD17B10L3MBTL1RAB9ANPC1 | |
| SCHEMBL14743988 | 0.83 | HTT (0.39) | ALDH1A1GPBAR1RAB9ANPC1ALOX15 | |
| SCHEMBL14744024 | 0.82 | GPBAR1 (0.42) | GPBAR1ALOX15 | |
| SCHEMBL14743624 | 0.80 | GPBAR1 (0.38) | GPBAR1MAPK1L3MBTL1ALOX15 | |
| SCHEMBL14743993 | 0.79 | MAPK1 (0.56) | ALDH1A1MAPK1L3MBTL1RAB9ANPC1 | |
| SCHEMBL14743411 | 0.77 | TDP1 (0.50) | ALDH1A1HSD17B10L3MBTL1NPC1 | |
| SCHEMBL14743646 | 0.77 | TSHR (0.43) | ALDH1A1L3MBTL1RAB9ANPC1 |
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-2013030358-A1 | GLYCINE B ANTAGONISTS | MERZ PHARMA GMBH & CO. KGAA (DE) | 2013-03-07 | — | — | WO | disclosed |