Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 7/20 | 0.48 |
| ▸ | SLC6A4 | P31645 | 7/20 | 0.48 |
| ▸ | NOTUM | Q6P988 | 2/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.39 |
| ▸ | USP2 | O75604 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | OPRM1 | P35372 | 5/20 | 0.35 |
| ▸ | OPRK1 | P41145 | 5/20 | 0.35 |
| ▸ | OPRL1 | P41146 | 5/20 | 0.35 |
| ▸ | OPRD1 | P41143 | 4/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | SLC18A3 | Q16572 | 2/20 | 0.35 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4717545 | 0.78 | SLC6A2 (0.60) | SLC6A2SLC6A4NOTUMHDAC1HDAC8 | |
| SCHEMBL12715915 | 0.76 | NOTUM (0.54) | SLC6A2SLC6A4NOTUMHDAC1HDAC8 | |
| SCHEMBL5484270 | 0.75 | SLC6A2 (0.79) | SLC6A2SLC6A4 | |
| SCHEMBL5482250 | 0.75 | SLC6A2 (0.79) | SLC6A2SLC6A4 | |
| SCHEMBL29948572 | 0.73 | SLC18A3 (0.56) | SLC6A2SLC6A4NOTUMHDAC1HDAC8 | |
| SCHEMBL14685818 | 0.73 | SLC18A3 (0.56) | SLC6A2SLC6A4NOTUMHDAC1HDAC8 | |
| SCHEMBL16686992 | 0.73 | NOTUM (0.48) | SLC6A2SLC6A4NOTUMHDAC1HDAC8 | |
| SCHEMBL1300971 | 0.72 | NOTUM (0.46) | SLC6A2SLC6A4NOTUMHDAC1HDAC8 | |
| SCHEMBL23666376 | 0.72 | SLC6A2 (0.50) | SLC6A2SLC6A4USP2CYP1A2CYP3A4 | |
| SCHEMBL13209332 | 0.71 | NOTUM (0.51) | SLC6A2SLC6A4NOTUMSLC18A3SIGMAR1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021145649-A1 | NOVEL N-HETEROCYCLIC CARBENE, TRANSITION METAL COMPLEX THEREOF, AND METHOD FOR PREPARING SAME | 포항공과대학교 산학협력단 | 2021-07-22 | — | — | WO | disclosed |