Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.47 |
| ▸ | GFER | P55789 | 2/20 | 0.47 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | RECQL | P46063 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | PRKCI | P41743 | 1/20 | 0.43 |
| ▸ | ACHE | P22303 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 6/20 | 0.40 |
| ▸ | ALDH1A3 | P47895 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 4/20 | 0.39 |
| ▸ | RET | P07949 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.36 |
| ▸ | S100B | P04271 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6080870 | 0.84 | PRKCI (0.47) | ALDH1A1L3MBTL1TSHRMAPK1GFER | |
| Hydrochloric Acid SCHEMBL9168202 | 0.82 | ACHE (0.49) | ALDH1A1L3MBTL1TSHRMAPK1GFER | |
| SCHEMBL5186192 | 0.79 | ALDH1A1 (0.50) | ALDH1A1L3MBTL1TSHRMAPK1GFER | |
| SCHEMBL15263534 | 0.78 | ALDH1A1 (0.48) | ALDH1A1L3MBTL1TSHRMAPK1GFER | |
| SCHEMBL7756464 | 0.76 | PRKCI (0.56) | ALDH1A1L3MBTL1TSHRMAPK1GFER | |
| SCHEMBL4817924 | 0.76 | CYP3A4 (0.47) | ALDH1A1L3MBTL1TSHRMAPK1GFER | |
| Hydrochloric Acid SCHEMBL9812556 | 0.76 | ALDH1A1 (0.47) | ALDH1A1L3MBTL1TSHRMAPK1GFER | |
| SCHEMBL8776727 | 0.75 | ALDH1A1 (0.50) | ALDH1A1L3MBTL1TSHRMAPK1GFER | |
| SCHEMBL8378141 | 0.74 | ALDH1A1 (0.53) | ALDH1A1L3MBTL1TSHRMAPK1GFER | |
| SCHEMBL28174299 | 0.74 | MAPT (0.41) | ALDH1A1L3MBTL1TSHRMAPK1GFER |
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 |
|---|---|---|---|---|---|---|---|
| EP-2791116-B1 | COUPLER WITH 7-AMINO-1,2,3,4-TETRAHYDROQUINOLINE STRUCTURE, DYEING COMPOSITION COMPRISING SAME, PROCESSES AND USES | OREAL (FR) | 2018-05-16 | — | — | EP | disclosed |