Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.52 |
| ▸ | HTR3E | A5X5Y0 | 2/20 | 0.50 |
| ▸ | HTR3B | O95264 | 2/20 | 0.50 |
| ▸ | HTR3A | P46098 | 2/20 | 0.50 |
| ▸ | HTR3D | Q70Z44 | 2/20 | 0.50 |
| ▸ | HTR3C | Q8WXA8 | 2/20 | 0.50 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.50 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.50 |
| ▸ | SLC22A3 | O75751 | 1/20 | 0.50 |
| ▸ | PLAU | P00749 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | NOS3 | P29474 | 6/20 | 0.47 |
| ▸ | NOS1 | P29475 | 6/20 | 0.47 |
| ▸ | NOS2 | P35228 | 5/20 | 0.47 |
| ▸ | ESR1 | P03372 | 1/20 | 0.42 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.42 |
| ▸ | IDO1 | P14902 | 1/20 | 0.39 |
| ▸ | CRHR1 | P34998 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9761794 | 1.00 | ALDH1A1 (0.52) | ALDH1A1HTR3EHTR3BHTR3AHTR3D | |
| SCHEMBL7461149 | 0.83 | HTR3E (0.50) | HTR3EHTR3BHTR3AHTR3DHTR3C | |
| SCHEMBL9342643 | 0.77 | ITGB3 (0.53) | HTR3EHTR3BHTR3AHTR3DHTR3C | |
| SCHEMBL9342646 | 0.77 | ITGB3 (0.53) | HTR3EHTR3BHTR3AHTR3DHTR3C | |
| SCHEMBL27836709 | 0.77 | HTR3E (0.58) | ALDH1A1HTR3EHTR3BHTR3AHTR3D | |
| SCHEMBL8197688 | 0.77 | HTR3E (0.58) | ALDH1A1HTR3EHTR3BHTR3AHTR3D | |
| SCHEMBL9764697 | 0.76 | ADRA2A (0.59) | ALDH1A1IDO1 | |
| SCHEMBL11816150 | 0.74 | HTR3E (0.61) | ALDH1A1HTR3EHTR3BHTR3AHTR3D | |
| Hydrochloric Acid SCHEMBL2867227 | 0.73 | NOS1 (0.68) | HTR3EHTR3BHTR3AHTR3DHTR3C | |
| SCHEMBL18543933 | 0.71 | ALDH1A1 (0.53) | ALDH1A1HTR3EHTR3BHTR3AHTR3D |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4992453-A | Certain thioimidate and amidine insecticides | ICI AMERICAS INC. (US) | 1991-02-12 | — | — | US | disclosed |
| US-4931448-A | Thiomidate insecticides | ICI AMERICAS INC. (US) | 1990-06-05 | — | — | US | disclosed |
| EP-0317266-A2 | Novel thioimidate and amidine insecticides | ICI AMERICAS INC. (US) | 1989-05-24 | — | — | EP | disclosed |