Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 14/20 | 0.49 |
| ▸ | OPRD1 | P41143 | 14/20 | 0.49 |
| ▸ | OPRK1 | P41145 | 14/20 | 0.49 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.46 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.43 |
| ▸ | HTR2A | P28223 | 1/20 | 0.43 |
| ▸ | HTR2C | P28335 | 1/20 | 0.43 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.43 |
| ▸ | HTR7 | P34969 | 1/20 | 0.43 |
| ▸ | HTR2B | P41595 | 1/20 | 0.43 |
| ▸ | HTR3A | P46098 | 1/20 | 0.43 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.43 |
| ▸ | HTR4 | Q13639 | 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 | |
|---|---|---|---|---|
| SCHEMBL4961595 | 0.87 | SLC6A2 (0.46) | OPRM1SLC6A2HTR2AHTR2CSLC6A4 | |
| Phenol SCHEMBL28176960 | 0.84 | OPRM1 (0.50) | OPRM1SLC6A2SLC6A3 | |
| SCHEMBL18611693 | 0.82 | HSD17B1 (0.52) | — | |
| Phenol SCHEMBL28176920 | 0.82 | CTSL (0.50) | OPRM1OPRD1OPRK1SLC6A2SLC6A3 | |
| SCHEMBL18615738 | 0.81 | CYP4F2 (0.44) | OPRM1OPRD1OPRK1SLC6A2HTR2A | |
| SCHEMBL18616219 | 0.81 | CARM1 (0.59) | HTR2CSLC6A4HTR2B | |
| SCHEMBL18617038 | 0.81 | SMN1; SMN2 (0.43) | OPRM1SLC6A2HTR2AHTR2CSLC6A4 | |
| SCHEMBL10204870 | 0.81 | IDO1 (0.53) | HTR2CSLC6A4 | |
| SCHEMBL16142823 | 0.81 | CARM1 (0.59) | SLC6A2HTR2AHTR2CSLC6A4HTR7 | |
| SCHEMBL18616222 | 0.81 | CARM1 (0.59) | SLC6A2SLC6A4SLC6A3 |
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 2 patents. 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 |
| WO-2017039331-A1 | HETEROARYL COMPOUNDS AND THEIR USE AS THERAPEUTIC DRUGS | DONG-A SOCIO HOLDINGS CO., LTD. (KR) | 2017-03-09 | — | — | WO | disclosed |