Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 2/20 | 0.37 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.37 |
| ▸ | MAP2K2 | P36507 | 1/20 | 0.35 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.34 |
| ▸ | USP8 | P40818 | 1/20 | 0.34 |
| ▸ | USP5 | P45974 | 1/20 | 0.34 |
| ▸ | USP4 | Q13107 | 1/20 | 0.34 |
| ▸ | USP7 | Q93009 | 1/20 | 0.34 |
| ▸ | GRM2 | Q14416 | 2/20 | 0.34 |
| ▸ | RAB9A | P51151 | 3/20 | 0.33 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.33 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | ICAM1 | P05362 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL11089219 | 0.81 | ALDH1A1 (0.42) | USP2USP8USP5USP4USP7 | |
| SCHEMBL11092051 | 0.80 | ALDH1A1 (0.46) | PARP1HTTTP53VCAM1ALDH1A1 | |
| SCHEMBL10869194 | 0.75 | SIRT1 (0.55) | MAP2K2MAP2K1RAB9AMAPTNPC1 | |
| SCHEMBL4640154 | 0.74 | GRM2 (0.44) | PARP1CSNK2A1MAP2K2MAP2K1GRM2 | |
| SCHEMBL11094258 | 0.73 | KDM4E (0.45) | PARP1USP2USP8USP5USP4 | |
| SCHEMBL20228268 | 0.73 | USP2 (0.35) | USP2USP8USP5USP4USP7 | |
| SCHEMBL10897641 | 0.72 | HAO1 (0.43) | USP2USP8USP5USP4USP7 | |
| SCHEMBL30673282 | 0.72 | HAO1 (0.43) | USP2USP8USP5USP4USP7 | |
| SCHEMBL14273075 | 0.72 | CYP1A2 (0.47) | CSNK2A1RAB9AMAPTNPC1KMT2A | |
| SCHEMBL1719977 | 0.71 | MAPK8 (0.39) | PARP1CSNK2A1MAP2K2MAP2K1GRM2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0018100-B1 | SUBSTITUTED AROMATIC BIOLOGICALLY ACTIVE COMPOUND, A PROCESS FOR ITS PREPARATION AND ITS USE AS BIOCIDE | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1984-01-18 | — | — | EP | disclosed |
| EP-0018100-A2 | Substituted aromatic biologically active compound, a process for its preparation and its use as biocide | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1980-10-29 | — | — | EP | disclosed |