Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRD1 | P41143 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 5/20 | 0.45 |
| ▸ | KDM1A | O60341 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 5/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.43 |
| ▸ | APP | P05067 | 1/20 | 0.43 |
| ▸ | HTR1A | P08908 | 1/20 | 0.43 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.43 |
| ▸ | DRD2 | P14416 | 1/20 | 0.43 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.43 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.43 |
| ▸ | HRH2 | P25021 | 1/20 | 0.43 |
| ▸ | HTR1D | P28221 | 1/20 | 0.43 |
| ▸ | HTR1B | P28222 | 1/20 | 0.43 |
| ▸ | HTR2A | P28223 | 1/20 | 0.43 |
| ▸ | HTR2C | P28335 | 1/20 | 0.43 |
| ▸ | HTR7 | P34969 | 1/20 | 0.43 |
| ▸ | DRD3 | P35462 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL29131873 | 1.00 | OPRD1 (0.46) | OPRD1TSHRKDM1ALMNAALDH1A1 | |
| SCHEMBL31719521 | 0.89 | APP (0.41) | OPRD1TSHRKDM1ALMNAALDH1A1 | |
| SCHEMBL29131855 | 0.79 | IL1B (0.43) | OPRD1KDM1APRMT5APPHTR1A | |
| SCHEMBL29131858 | 0.79 | IL1B (0.43) | OPRD1KDM1APRMT5APPHTR1A | |
| SCHEMBL12311356 | 0.79 | OPRD1 (0.53) | OPRD1TSHRKDM1ALMNAALDH1A1 | |
| SCHEMBL29326010 | 0.77 | ALDH1A1 (0.41) | OPRD1TSHRKDM1ALMNAALDH1A1 | |
| SCHEMBL16336962 | 0.77 | STK17B (0.51) | OPRD1TSHRKDM1ALMNAALDH1A1 | |
| SCHEMBL16337923 | 0.77 | STK17B (0.51) | OPRD1TSHRKDM1ALMNAALDH1A1 | |
| SCHEMBL15056902 | 0.77 | STK17B (0.51) | OPRD1TSHRKDM1ALMNAALDH1A1 | |
| SCHEMBL16008708 | 0.77 | BTK (0.46) | OPRD1KDM1APRMT5APPHTR1A |
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-116969920-A | Fused pyridazine derivative, preparation method and medical application thereof | 上海辉启生物医药科技有限公司 | 2023-10-31 | — | — | CN | disclosed |