Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.38 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.38 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | GBA1 | P04062 | 1/20 | 0.37 |
| ▸ | USP2 | O75604 | 1/20 | 0.37 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL14661101 | 0.81 | PTGDR2 (0.45) | SLC6A3 | |
| SCHEMBL28068538 | 0.80 | PTGDR2 (0.36) | TSHRKMT2AADRA2AADRA2BADRA2C | |
| SCHEMBL2062415 | 0.77 | PTGDR2 (0.41) | TSHRADRA2AUSP2SLC6A3 | |
| SCHEMBL2062805 | 0.77 | PTGDR2 (0.41) | TSHRADRA2AUSP2SLC6A3 | |
| SCHEMBL1222346 | 0.77 | PTGDR2 (0.41) | TSHRADRA2AUSP2SLC6A3 | |
| SCHEMBL11467456 | 0.76 | PTGDR2 (0.43) | TSHRKMT2ASLC6A3MEN1 | |
| SCHEMBL3697021 | 0.75 | CASP1 (0.45) | KMT2AADRA2AALDH1A1 | |
| SCHEMBL2374002 | 0.75 | KMT2A (0.44) | TSHRKMT2AALDH1A1MEN1 | |
| SCHEMBL21784764 | 0.74 | TSHR (0.39) | TSHRALDH1A1USP2SLC6A3 | |
| SCHEMBL21780570 | 0.74 | SLC6A3 (0.39) | TSHRALDH1A1SLC6A3 |
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-103687860-B | As P2X7Heterocyclic amide derivatives of receptor antagonists | 埃科特莱茵药品有限公司 | 2016-06-08 | — | — | CN | disclosed |