Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 1/20 | 0.57 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.55 |
| ▸ | TSHR | P16473 | 2/20 | 0.52 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.52 |
| ▸ | LMNA | P02545 | 2/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.52 |
| ▸ | MAPT | P10636 | 3/20 | 0.51 |
| ▸ | NPC1 | O15118 | 1/20 | 0.51 |
| ▸ | RAB9A | P51151 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | APOBEC3A | P31941 | 2/20 | 0.49 |
| ▸ | APOBEC3G | Q9HC16 | 2/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL28846715 | 1.00 | GAA (0.57) | GAAHSD17B10TSHRALOX15LMNA | |
| SCHEMBL13753536 | 0.81 | TSHR (0.68) | GAAHSD17B10TSHRALOX15LMNA | |
| SCHEMBL6290034 | 0.80 | ALDH1A1 (0.60) | GAAHSD17B10TSHRALOX15LMNA | |
| SCHEMBL6290035 | 0.80 | ALDH1A1 (0.60) | GAAHSD17B10TSHRALOX15LMNA | |
| SCHEMBL13570399 | 0.79 | ALDH1A1 (0.59) | GAAHSD17B10TSHRALOX15LMNA | |
| SCHEMBL6184573 | 0.77 | ALDH1A1 (0.51) | HSD17B10LMNAALDH1A1MAPTNPC1 | |
| SCHEMBL16465976 | 0.76 | LMNA (0.60) | GAAHSD17B10TSHRALOX15LMNA | |
| SCHEMBL27896515 | 0.76 | HSD17B10 (0.50) | GAAHSD17B10TSHRALOX15LMNA | |
| SCHEMBL16465977 | 0.76 | LMNA (0.60) | GAAHSD17B10TSHRALOX15LMNA | |
| SCHEMBL27764349 | 0.76 | L3MBTL1 (0.53) | GAAALDH1A1POLB |
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 |
|---|---|---|---|---|---|---|---|
| CN-104703980-B | Belong to the orexin receptor antagonists of [adjacent double (miscellaneous) aryl] [base of 2 (double (miscellaneous) aryl) pyrrolidines 1] ketone derivatives | 埃科特莱茵药品有限公司 | 2017-09-22 | — | — | CN | disclosed |