Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.50 |
| ▸ | RAB9A | P51151 | 2/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | GRM5 | P41594 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.43 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.43 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.43 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.43 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL6702666 | 0.89 | TSHR (0.56) | NPC1RAB9ATSHRMAPTGRM5 | |
| SCHEMBL1987313 | 0.85 | TSHR (0.52) | NPC1RAB9ATSHRMAPTGRM5 | |
| SCHEMBL203767 | 0.85 | TSHR (0.56) | NPC1RAB9ATSHRTP53MAPT | |
| SCHEMBL476827 | 0.85 | TSHR (0.61) | NPC1RAB9ATSHRMAPTGRM5 | |
| SCHEMBL3986734 | 0.82 | NPC1 (0.49) | NPC1RAB9ATSHRMAPTGRM5 | |
| SCHEMBL9622282 | 0.82 | NPC1 (0.52) | NPC1RAB9ATSHRMAPTGRM5 | |
| SCHEMBL29153306 | 0.82 | ALDH1A1 (0.52) | NPC1RAB9ATSHRMAPTGRM5 | |
| Formaldehyde SCHEMBL8658362 | 0.81 | TSHR (0.56) | NPC1RAB9ATSHRMAPTGRM5 | |
| SCHEMBL9152703 | 0.81 | NPC1 (0.51) | NPC1RAB9ATSHRMAPTGRM5 | |
| SCHEMBL126148 | 0.81 | NPC1 (0.55) | NPC1RAB9ATSHRMAPTGRM5 |
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-104053727-B | Thiophene azo carboxylate's dyestuff and comprise its fabric care composition | MILLIKEN & CO. (US) | 2016-11-30 | — | — | CN | disclosed |