Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 5/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.44 |
| ▸ | HRH1 | P35367 | 2/20 | 0.44 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.44 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.44 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.44 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.44 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.44 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.43 |
| ▸ | HTR2C | P28335 | 1/20 | 0.43 |
| ▸ | HTR7 | P34969 | 1/20 | 0.43 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.43 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 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 | |
|---|---|---|---|---|
| SCHEMBL14263242 | 0.83 | MAOB (0.48) | SLC6A2SLC6A3MEN1POLBKMT2A | |
| SCHEMBL12530260 | 0.80 | IDO1 (0.55) | SLC6A2SLC6A3SLC6A4SIGMAR1LMNA | |
| SCHEMBL14263251 | 0.79 | CALM1 (0.55) | SLC6A4MEN1KMT2ASIGMAR1MAPK1 | |
| SCHEMBL8306214 | 0.79 | IGF1R (0.45) | KCNH2IGF1RALOX15PPARGPPARA | |
| SCHEMBL3655884 | 0.78 | KCNH2 (0.47) | KCNH2SLC6A2HRH1HRH3SLC6A3 | |
| SCHEMBL9249000 | 0.77 | SLC6A2 (0.64) | KCNH2SLC6A2HRH1HRH3SLC6A3 | |
| SCHEMBL7303881 | 0.77 | LMNA (0.35) | KMT2ALMNAMAPK1 | |
| SCHEMBL12530528 | 0.77 | TSHR (0.50) | HRH1HRH3MEN1KMT2AMAPK1 | |
| SCHEMBL10819594 | 0.75 | IDO1 (0.52) | SLC6A2SLC6A3SLC6A4PPARGPPARA | |
| SCHEMBL22281732 | 0.74 | IDO1 (0.48) | SIGMAR1 |
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-3344616-B1 | SUBSTITUTED AMINO TRIAZOLES USEFUL AS HUMAN CHITINASE INHIBITORS | ONCOARENDI THERAPEUTICS SA (PL) | 2019-01-09 | — | — | EP | disclosed |