Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | PTGER1 | P34995 | 8/20 | 0.36 |
| ▸ | HTR2C | P28335 | 2/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.36 |
| ▸ | AHCY | P23526 | 1/20 | 0.36 |
| ▸ | ANO1 | Q5XXA6 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | EPHA2 | P29317 | 1/20 | 0.35 |
| ▸ | KDR | P35968 | 1/20 | 0.35 |
| ▸ | EPHB4 | P54760 | 1/20 | 0.35 |
| ▸ | HTR2B | P41595 | 1/20 | 0.35 |
| ▸ | GRM5 | P41594 | 1/20 | 0.34 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL30740733 | 0.93 | ALDH1A1 (0.41) | ALDH1A1MEN1LMNAMAPTTSHR | |
| SCHEMBL30740746 | 0.87 | ALDH1A1 (0.40) | ALDH1A1MEN1LMNAMAPTTSHR | |
| SCHEMBL29826118 | 0.86 | CACNB4 (0.44) | CYP2C9 | |
| SCHEMBL30740829 | 0.85 | LMNA (0.46) | ALDH1A1MEN1LMNAKMT2AEPHA2 | |
| SCHEMBL30745378 | 0.81 | SCN9A (0.39) | ALDH1A1GRM5 | |
| SCHEMBL30740755 | 0.80 | LNPEP (0.38) | ALDH1A1LMNANPSR1OPRK1 | |
| SCHEMBL30740827 | 0.79 | GPR119 (0.38) | — | |
| SCHEMBL29826391 | 0.79 | CACNB4 (0.44) | CYP2C9 | |
| SCHEMBL29826215 | 0.76 | CYP2C9 (0.44) | TSHRCYP2C9 | |
| SCHEMBL27477980 | 0.75 | USP30 (0.38) | ALDH1A1HTR2CSLC6A4HTR2BGRM5 |
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 |
|---|---|---|---|---|---|---|---|
| CN-117043154-A | GPCR receptor agonists, pharmaceutical compositions comprising same, and methods of use thereof | 卡莫特医疗有限公司 | 2023-11-10 | — | — | CN | disclosed |