Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 5/20 | 0.60 |
| ▸ | SLC6A4 | P31645 | 5/20 | 0.60 |
| ▸ | SLC6A3 | Q01959 | 5/20 | 0.60 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.60 |
| ▸ | HTR2C | P28335 | 3/20 | 0.48 |
| ▸ | HTR2B | P41595 | 3/20 | 0.48 |
| ▸ | HTR2A | P28223 | 1/20 | 0.48 |
| ▸ | HTR7 | P34969 | 1/20 | 0.48 |
| ▸ | HTR3A | P46098 | 1/20 | 0.48 |
| ▸ | HTR4 | Q13639 | 1/20 | 0.48 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.47 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.47 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.47 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.47 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.47 |
| ▸ | NAAA | Q02083 | 2/20 | 0.46 |
| ▸ | DRD4 | P21917 | 2/20 | 0.43 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.43 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.43 |
| ▸ | KDM1A | O60341 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL18616335 | 1.00 | SLC6A2 (0.60) | SLC6A2SLC6A4SLC6A3KCNH2HTR2C | |
| Hydrochloric Acid SCHEMBL2980843 | 0.98 | SLC6A2 (0.58) | SLC6A2SLC6A4SLC6A3KCNH2HTR2C | |
| Hydrochloric Acid SCHEMBL2969227 | 0.98 | SLC6A2 (0.58) | SLC6A2SLC6A4SLC6A3KCNH2HTR2C | |
| SCHEMBL7159318 | 0.90 | SLC6A2 (0.58) | SLC6A2SLC6A4SLC6A3KCNH2HTR2C | |
| SCHEMBL18792538 | 0.86 | NAAA (0.50) | SLC6A2SLC6A4SLC6A3KCNH2HTR2C | |
| Hydrochloric Acid SCHEMBL2976614 | 0.85 | SLC6A2 (0.58) | SLC6A2SLC6A4SLC6A3KCNH2HTR2C | |
| SCHEMBL654966 | 0.83 | SLC6A4 (0.60) | SLC6A2SLC6A4SLC6A3KCNH2HTR2C | |
| SCHEMBL21638189 | 0.83 | SLC6A4 (0.74) | SLC6A2SLC6A4SLC6A3KCNH2HTR2C | |
| SCHEMBL654491 | 0.83 | SLC6A4 (0.60) | SLC6A2SLC6A4SLC6A3KCNH2HTR2C | |
| SCHEMBL654490 | 0.83 | SLC6A4 (0.60) | SLC6A2SLC6A4SLC6A3KCNH2HTR2C |
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-3344613-B1 | HETEROARYL COMPOUNDS AND THEIR USE AS THERAPEUTIC DRUGS | DONG A SOCIO HOLDINGS CO LTD (KR) | 2020-03-04 | — | — | EP | disclosed |