Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | GRIN2B | Q13224 | 3/20 | 0.41 |
| ▸ | GBA1 | P04062 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.40 |
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | RORC | P51449 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.39 |
| ▸ | ATXN2 | Q99700 | 1/20 | 0.39 |
| ▸ | ACACB | O00763 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | F13A1 | P00488 | 1/20 | 0.38 |
| ▸ | TGM2 | P21980 | 1/20 | 0.38 |
| ▸ | TGM1 | P22735 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL31634701 | 1.00 | GRM5 (0.44) | GRM5CYP1A2CYP3A4GRIN2BGBA1 | |
| SCHEMBL31634718 | 0.86 | RAB9A (0.44) | GRIN2BSMN1; SMN2NPC1RAB9ARORC | |
| SCHEMBL30948981 | 0.86 | RAB9A (0.44) | GRIN2BSMN1; SMN2NPC1RAB9ARORC | |
| SCHEMBL30210344 | 0.81 | SMN1; SMN2 (0.48) | GRIN2BSMN1; SMN2NPC1RAB9ARORC | |
| SCHEMBL30948984 | 0.81 | NR1H2 (0.46) | GRIN2BSMN1; SMN2NPC1RAB9ARORC | |
| SCHEMBL34473906 | 0.79 | SMN1; SMN2 (0.46) | GRIN2BSMN1; SMN2NPC1RAB9ARORC | |
| SCHEMBL31634669 | 0.77 | RORC (0.35) | GRIN2BSMN1; SMN2NPC1RAB9ARORC | |
| SCHEMBL30948971 | 0.77 | RORC (0.35) | GRIN2BSMN1; SMN2NPC1RAB9ARORC | |
| SCHEMBL29944809 | 0.75 | ENPP2 (0.37) | GRIN2BSMN1; SMN2NPC1RAB9ACYP2C19 | |
| SCHEMBL31634703 | 0.75 | PDE4B (0.47) | SMN1; SMN2NPC1RAB9ARORCCYP2C19 |
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-2024104452-A1 | MC4R ANTAGONIST COMPOUND, PHARMACEUTICAL COMPOSITION AND PHARMACEUTICAL USE THEREOF | 长春金赛药业有限责任公司 | 2024-05-23 | — | — | WO | disclosed |