Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PNMT | P11086 | 5/20 | 0.54 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.54 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.54 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.54 |
| ▸ | DRD2 | P14416 | 2/20 | 0.44 |
| ▸ | DRD3 | P35462 | 2/20 | 0.44 |
| ▸ | DRD4 | P21917 | 1/20 | 0.44 |
| ▸ | MRGPRX2 | Q96LB1 | 2/20 | 0.43 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.41 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.41 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL19453935 | 1.00 | PNMT (0.54) | PNMTADRA2AADRA2BADRA2CDRD2 | |
| SCHEMBL4014450 | 1.00 | PNMT (0.54) | PNMTADRA2AADRA2BADRA2CDRD2 | |
| SCHEMBL5678366 | 0.93 | PNMT (0.64) | PNMTADRA2AADRA2BADRA2CMRGPRX2 | |
| SCHEMBL12168266 | 0.93 | PNMT (0.64) | PNMTADRA2AADRA2BADRA2CMRGPRX2 | |
| SCHEMBL11455524 | 0.84 | DRD2 (0.50) | DRD2DRD3DRD4OPRM1OPRD1 | |
| Bromide SCHEMBL11463856 | 0.82 | DRD2 (0.49) | DRD2DRD3DRD4OPRM1OPRD1 | |
| SCHEMBL6211310 | 0.82 | OPRK1 (0.49) | DRD2DRD3DRD4OPRK1 | |
| SCHEMBL14993735 | 0.81 | PNMT (0.54) | PNMTADRA2AADRA2BADRA2C | |
| SCHEMBL29051781 | 0.81 | DRD2 (0.46) | PNMTADRA2AADRA2BADRA2CDRD2 | |
| SCHEMBL29051837 | 0.80 | OPRK1 (0.50) | PNMTADRA2AADRA2BADRA2CDRD2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115667275-B | Boron-containing compounds and uses thereof | 南京再明医药有限公司 | 2024-02-23 | — | — | CN | disclosed |
| CN-115667275-A | Boron-containing compounds and their use | 先声药业有限公司 | 2023-01-31 | — | — | CN | disclosed |