Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 5/20 | 0.42 |
| ▸ | POLB | P06746 | 3/20 | 0.39 |
| ▸ | HTR3E | A5X5Y0 | 2/20 | 0.38 |
| ▸ | HTR3B | O95264 | 2/20 | 0.38 |
| ▸ | HTR3A | P46098 | 2/20 | 0.38 |
| ▸ | HTR3D | Q70Z44 | 2/20 | 0.38 |
| ▸ | HTR3C | Q8WXA8 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.38 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.38 |
| ▸ | SLC22A3 | O75751 | 1/20 | 0.38 |
| ▸ | PLAU | P00749 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.36 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.36 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.36 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.36 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL11844974 | 0.82 | ALDH1A1 (0.44) | SIGMAR1HTR3EHTR3BHTR3AHTR3D | |
| SCHEMBL11844957 | 0.82 | ALDH1A1 (0.44) | SIGMAR1HTR3EHTR3BHTR3AHTR3D | |
| SCHEMBL11836951 | 0.79 | SIGMAR1 (0.53) | SIGMAR1PLAUALDH1A1LMNAHPGD | |
| SCHEMBL11836941 | 0.79 | SIGMAR1 (0.53) | SIGMAR1PLAUALDH1A1LMNAHPGD | |
| SCHEMBL11835035 | 0.78 | HTR3E (0.65) | SIGMAR1HTR3EHTR3BHTR3AHTR3D | |
| SCHEMBL11371559 | 0.75 | ALDH1A1 (0.40) | POLBHTR3EHTR3BHTR3AHTR3D | |
| SCHEMBL18311982 | 0.75 | ALDH1A1 (0.47) | POLBTDP1CYP2C19ALDH1A1CHRNB2 | |
| Hydrochloric Acid SCHEMBL27449209 | 0.73 | ALDH1A1 (0.46) | POLBTDP1CYP2C19ALDH1A1CHRNB2 | |
| SCHEMBL12550518 | 0.70 | POLB (0.50) | POLBTDP1CYP2C19ALDH1A1CHRNB2 | |
| SCHEMBL11722801 | 0.69 | ALDH1A1 (0.38) | POLBTDP1ALDH1A1CHRNB2CHRNB4 |
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-3954995-A | Mono-and disubstituted hydroxyguanidines in the treatment of depression | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1976-05-04 | — | — | US | claimed |