Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.33 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.33 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.33 |
| ▸ | DRD2 | P14416 | 3/20 | 0.33 |
| ▸ | DRD4 | P21917 | 3/20 | 0.33 |
| ▸ | DRD3 | P35462 | 3/20 | 0.33 |
| ▸ | PDE4A | P27815 | 2/20 | 0.33 |
| ▸ | PDE4C | Q08493 | 2/20 | 0.33 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | DRD1 | P21728 | 1/20 | 0.33 |
| ▸ | DRD5 | P21918 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 3/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | STAT3 | P40763 | 2/20 | 0.33 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL19959255 | 0.81 | CYP1A2 (0.43) | HSD17B10KDM4EALDH1A1ADORA2AADORA1 | |
| SCHEMBL28211609 | 0.81 | ADORA2A (0.34) | HSD17B10KDM4EALDH1A1ADORA2AADORA1 | |
| SCHEMBL31722992 | 0.81 | ADORA2A (0.39) | HSD17B10KDM4EALDH1A1ADORA2AADORA1 | |
| SCHEMBL6937631 | 0.79 | GPR84 (0.45) | HSD17B10KDM4EALDH1A1ADORA2AADORA1 | |
| SCHEMBL1408383 | 0.79 | TUBB4A (0.45) | KDM4EALDH1A1HPGDLMNAHTT | |
| SCHEMBL30064889 | 0.79 | TUBB4A (0.45) | KDM4EALDH1A1HPGDLMNAHTT | |
| SCHEMBL19637178 | 0.78 | DRD2 (0.36) | DRD2DRD4DRD3DRD1DRD5 | |
| SCHEMBL2656359 | 0.78 | NQO2 (0.43) | HSD17B10KDM4EALDH1A1ADORA2AADORA1 | |
| SCHEMBL30064989 | 0.78 | NQO2 (0.43) | HSD17B10KDM4EALDH1A1ADORA2AADORA1 | |
| SCHEMBL15998741 | 0.78 | HTT (0.39) | HSD17B10KDM4EALDH1A1ADORA2AADORA1 |
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-116396334-A | Preparation method of cyclic phosphonium borate derivative | 石河子大学 | 2023-07-07 | — | — | CN | disclosed |