Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.43 |
| ▸ | HTR3B | O95264 | 1/20 | 0.43 |
| ▸ | PLAU | P00749 | 1/20 | 0.43 |
| ▸ | HTR3A | P46098 | 1/20 | 0.43 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.43 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.43 |
| ▸ | NQO2 | P16083 | 1/20 | 0.42 |
| ▸ | KIF11 | P52732 | 1/20 | 0.38 |
| ▸ | GALR3 | O60755 | 1/20 | 0.37 |
| ▸ | MPI | P34949 | 1/20 | 0.37 |
| ▸ | KDM1A | O60341 | 1/20 | 0.37 |
| ▸ | NOS3 | P29474 | 2/20 | 0.37 |
| ▸ | NOS1 | P29475 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.36 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9367254 | 0.78 | KDM4E (0.44) | HTR3EHTR3BPLAUHTR3AHTR3D | |
| SCHEMBL7987703 | 0.73 | CES2 (0.46) | NQO2PTGS2LMNAMAPTRAB9A | |
| SCHEMBL7970456 | 0.71 | LRRK2 (0.44) | MPINOS3NOS1ALDH1A1KDM4E | |
| SCHEMBL3294022 | 0.70 | KIF11 (0.60) | NQO2KIF11ALDH1A1PTGS1KDM4E | |
| SCHEMBL7983283 | 0.68 | NQO2 (0.54) | NQO2KIF11PTGS2PTGS1CYP1A2 | |
| SCHEMBL187014 | 0.65 | NQO2 (0.61) | NQO2KIF11ALDH1A1PTGS2PTGS1 | |
| SCHEMBL4662793 | 0.65 | HTR3E (0.47) | HTR3EHTR3BPLAUHTR3AHTR3D | |
| SCHEMBL3773702 | 0.65 | KIF11 (0.64) | HTR3EHTR3BPLAUHTR3AHTR3D | |
| SCHEMBL3773700 | 0.65 | KIF11 (0.64) | HTR3EHTR3BPLAUHTR3AHTR3D | |
| SCHEMBL23968981 | 0.64 | KIF11 (0.47) | KIF11PIK3CA |
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 |
|---|---|---|---|---|---|---|---|
| US-6271406-B1 | HYDROGENATING HALOGENATED 1,2-DISILAETHYLENES | WACKER-CHEMIE GMBH (DE) | 2001-08-07 | — | — | US | disclosed |