Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RORC | P51449 | 2/20 | 0.35 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.34 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.34 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.34 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.34 |
| ▸ | MC4R | P32245 | 2/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
| ▸ | F13A1 | P00488 | 1/20 | 0.33 |
| ▸ | TGM2 | P21980 | 1/20 | 0.33 |
| ▸ | TGM1 | P22735 | 1/20 | 0.33 |
| ▸ | CCR5 | P51681 | 1/20 | 0.33 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | ENPP2 | Q13822 | 4/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | PARP1 | P09874 | 1/20 | 0.32 |
| ▸ | ACACB | O00763 | 1/20 | 0.32 |
| ▸ | ATXN2 | Q99700 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL31634669 | 1.00 | RORC (0.35) | RORCPDK1PDK2PDK3PDK4 | |
| SCHEMBL31634678 | 0.85 | PTGDR2 (0.35) | RORCF13A1TGM2TGM1CCR5 | |
| SCHEMBL30948983 | 0.85 | PTGDR2 (0.35) | RORCF13A1TGM2TGM1CCR5 | |
| SCHEMBL31634667 | 0.83 | GRIN2B (0.36) | RORCF13A1TGM2TGM1ENPP2 | |
| SCHEMBL30948965 | 0.83 | GRIN2B (0.36) | RORCF13A1TGM2TGM1ENPP2 | |
| SCHEMBL31634718 | 0.80 | RAB9A (0.44) | RORCF13A1TGM2TGM1CHRM4 | |
| SCHEMBL30948981 | 0.80 | RAB9A (0.44) | RORCF13A1TGM2TGM1CHRM4 | |
| SCHEMBL31634688 | 0.78 | PIM1 (0.32) | MC4RKCNH2F13A1TGM2TGM1 | |
| SCHEMBL31634701 | 0.77 | GRM5 (0.44) | RORCF13A1TGM2TGM1HTT | |
| SCHEMBL30948974 | 0.77 | GRM5 (0.44) | RORCF13A1TGM2TGM1HTT |
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 |