Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB1 | P08588 | 5/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.58 |
| ▸ | LMNA | P02545 | 1/20 | 0.58 |
| ▸ | SIRT6 | Q8N6T7 | 1/20 | 0.58 |
| ▸ | HTR6 | P50406 | 3/20 | 0.55 |
| ▸ | MAPT | P10636 | 6/20 | 0.47 |
| ▸ | RECQL | P46063 | 1/20 | 0.47 |
| ▸ | HTR3E | A5X5Y0 | 3/20 | 0.45 |
| ▸ | HTR3B | O95264 | 3/20 | 0.45 |
| ▸ | HTR3A | P46098 | 3/20 | 0.45 |
| ▸ | HTR3D | Q70Z44 | 3/20 | 0.45 |
| ▸ | HTR3C | Q8WXA8 | 3/20 | 0.45 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL10607953 | 0.77 | ALDH1A1 (0.59) | ADRB1ALDH1A1KDM4ELMNASIRT6 | |
| SCHEMBL4573165 | 0.77 | ALDH1A1 (0.59) | ADRB1ALDH1A1KDM4ELMNASIRT6 | |
| SCHEMBL28153182 | 0.76 | ADRB1 (0.58) | ADRB1ALDH1A1KDM4ELMNASIRT6 | |
| SCHEMBL31531621 | 0.75 | ALDH1A1 (0.71) | ADRB1ALDH1A1KDM4ELMNASIRT6 | |
| SCHEMBL4573220 | 0.75 | ALDH1A1 (0.56) | ADRB1ALDH1A1KDM4ELMNASIRT6 | |
| SCHEMBL7526992 | 0.74 | SIRT6 (1.00) | ADRB1ALDH1A1KDM4ELMNASIRT6 | |
| SCHEMBL532144 | 0.74 | ALDH1A1 (0.69) | ADRB1ALDH1A1KDM4ELMNASIRT6 | |
| SCHEMBL4518266 | 0.74 | ALDH1A1 (1.00) | ADRB1ALDH1A1KDM4ELMNASIRT6 | |
| SCHEMBL336262 | 0.74 | SIRT6 (1.00) | ADRB1ALDH1A1KDM4ELMNASIRT6 | |
| SCHEMBL17902921 | 0.73 | ALDH1A1 (0.63) | ADRB1ALDH1A1KDM4ELMNASIRT6 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0408714-A1 | HETEROCYCLIC SULPHONYLNITROMETHANES, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS. | ICI PLC (GB) | 1991-01-23 | — | — | EP | disclosed |