Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR4 | O00206 | 1/20 | 0.50 |
| ▸ | TLR2 | O60603 | 1/20 | 0.50 |
| ▸ | MGLL | Q99685 | 1/20 | 0.50 |
| ▸ | GRM5 | P41594 | 1/20 | 0.48 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.47 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | RET | P07949 | 1/20 | 0.43 |
| ▸ | KIF5B | P33176 | 1/20 | 0.43 |
| ▸ | KDR | P35968 | 1/20 | 0.43 |
| ▸ | IP6K1 | Q92551 | 1/20 | 0.43 |
| ▸ | IP6K3 | Q96PC2 | 1/20 | 0.43 |
| ▸ | IP6K2 | Q9UHH9 | 1/20 | 0.43 |
| ▸ | PPARG | P37231 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.40 |
| ▸ | MBD2 | Q9UBB5 | 1/20 | 0.40 |
| ▸ | DRD1 | P21728 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL2582155 | 1.00 | TLR4 (0.50) | TLR4TLR2MGLLGRM5FFAR4 | |
| SCHEMBL29612417 | 0.87 | TLR4 (0.56) | TLR4TLR2GRM5FFAR4MAP4K4 | |
| SCHEMBL12129555 | 0.87 | TLR4 (0.56) | TLR4TLR2GRM5FFAR4MAP4K4 | |
| SCHEMBL15602369 | 0.85 | TLR4 (0.55) | TLR4TLR2GRM5FFAR4MAP4K4 | |
| SCHEMBL5686998 | 0.83 | SCN7A (0.47) | TLR4TLR2MGLLKDM4EPPARG | |
| SCHEMBL15387423 | 0.82 | HRH3 (0.44) | TLR4TLR2MGLLGRM5FFAR4 | |
| SCHEMBL3334396 | 0.82 | ESR2 (0.53) | TLR4TLR2MGLLGRM5MAP4K4 | |
| SCHEMBL5109000 | 0.81 | MAP4K4 (0.57) | TLR4TLR2GRM5FFAR4MAP4K4 | |
| SCHEMBL12168388 | 0.81 | F2 (0.53) | KDM4ERETKIF5BKDRRAB9A | |
| SCHEMBL6091732 | 0.81 | CHRNB2 (0.51) | MGLLAPP |
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-110272456-B | Organometallic compound and organic light emitting device including the same | 三星显示有限公司 | 2024-04-05 | — | — | CN | disclosed |