Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | GLA | P06280 | 1/20 | 0.44 |
| ▸ | TNNI3 | P19429 | 1/20 | 0.44 |
| ▸ | TNNT2 | P45379 | 1/20 | 0.44 |
| ▸ | TNNC1 | P63316 | 1/20 | 0.44 |
| ▸ | RUNX1 | Q01196 | 1/20 | 0.44 |
| ▸ | CBFB | Q13951 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL5782916 | 0.83 | ALDH1A1 (0.42) | ALDH1A1HSD17B10CYP1A2SMN1; SMN2MEN1 | |
| SCHEMBL11754501 | 0.81 | ALDH1A1 (0.47) | ALDH1A1HSD17B10CYP1A2L3MBTL1HTT | |
| SCHEMBL4696811 | 0.81 | HSD17B10 (0.47) | ALDH1A1HSD17B10L3MBTL1HTTSMN1; SMN2 | |
| SCHEMBL7406905 | 0.81 | ALDH1A1 (0.52) | ALDH1A1HSD17B10CYP1A2L3MBTL1HTT | |
| SCHEMBL28100309 | 0.81 | ALDH1A1 (0.55) | ALDH1A1HSD17B10CYP1A2L3MBTL1HTT | |
| SCHEMBL4066831 | 0.81 | HSD17B10 (0.52) | ALDH1A1HSD17B10CYP1A2L3MBTL1HTT | |
| SCHEMBL4328076 | 0.79 | DYRK1A (0.43) | ALDH1A1L3MBTL1SMN1; SMN2MEN1MAPT | |
| SCHEMBL5782169 | 0.79 | DYRK1A (0.43) | ALDH1A1HSD17B10CYP1A2L3MBTL1HTT | |
| SCHEMBL197626 | 0.79 | KDM4E (0.45) | ALDH1A1HSD17B10SMN1; SMN2MEN1KMT2A | |
| SCHEMBL7068909 | 0.79 | ALDH1A1 (0.49) | ALDH1A1HSD17B10CYP1A2L3MBTL1HTT |
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-0752451-B1 | The use of 4,5-dihydro-1H-1,2,3-triazolium cationic compounds as dyestuffs | BAYER AG (DE) | 2001-10-17 | — | — | EP | disclosed |