Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DAO | P14920 | 3/20 | 0.56 |
| ▸ | CES1 | P23141 | 5/20 | 0.51 |
| ▸ | NSD2 | O96028 | 1/20 | 0.51 |
| ▸ | BCHE | P06276 | 1/20 | 0.51 |
| ▸ | LIG1 | P18858 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | CASP3 | P42574 | 1/20 | 0.41 |
| ▸ | CASP2 | P42575 | 1/20 | 0.41 |
| ▸ | CASP7 | P55210 | 1/20 | 0.41 |
| ▸ | CASP6 | P55212 | 1/20 | 0.41 |
| ▸ | CASP8 | Q14790 | 1/20 | 0.41 |
| ▸ | ELANE | P08246 | 2/20 | 0.40 |
| ▸ | MAOA | P21397 | 2/20 | 0.40 |
| ▸ | MAOB | P27338 | 2/20 | 0.40 |
| ▸ | CTSG | P08311 | 1/20 | 0.40 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.34 |
| ▸ | ALDH3A1 | P30838 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL9686821 | 0.89 | DAO (0.51) | DAOCES1NSD2BCHELIG1 | |
| SCHEMBL951019 | 0.87 | DAO (0.61) | DAOCES1NSD2BCHELIG1 | |
| SCHEMBL20303987 | 0.79 | CES1 (0.55) | DAOCES1NSD2BCHELIG1 | |
| SCHEMBL10648890 | 0.79 | CES1 (0.55) | DAOCES1NSD2BCHELIG1 | |
| SCHEMBL1892075 | 0.74 | KDM4E (0.45) | DAOCASP3CASP2CASP7CASP6 | |
| SCHEMBL16111392 | 0.72 | CES1 (0.51) | DAOCES1ELANEMAOAMAOB | |
| Butane SCHEMBL28094097 | 0.72 | CES1 (0.84) | DAOCES1NSD2BCHELIG1 | |
| SCHEMBL3088689 | 0.72 | DAO (1.00) | DAOCES1NSD2BCHELIG1 | |
| SCHEMBL30900454 | 0.71 | DAO (0.38) | DAOELANECTSGPDK2POLB | |
| SCHEMBL5329295 | 0.71 | DAO (0.54) | DAOCES1NSD2BCHELIG1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007132280-A1 | ISATIN AND ITS DERIVATIVES FOR USE AS A MEDICAMENT | Szegedi Tudományegyetem (HU) | 2007-11-22 | — | — | WO | disclosed |