Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 1/20 | 0.57 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.54 |
| ▸ | AOC3 | Q16853 | 4/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | RECQL | P46063 | 1/20 | 0.49 |
| ▸ | PYCR1 | P32322 | 1/20 | 0.49 |
| ▸ | HTR3E | A5X5Y0 | 3/20 | 0.47 |
| ▸ | HTR3B | O95264 | 3/20 | 0.47 |
| ▸ | HTR3A | P46098 | 3/20 | 0.47 |
| ▸ | HTR3D | Q70Z44 | 3/20 | 0.47 |
| ▸ | HTR3C | Q8WXA8 | 3/20 | 0.47 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.47 |
| ▸ | PNMT | P11086 | 2/20 | 0.46 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.45 |
| ▸ | IDO1 | P14902 | 2/20 | 0.44 |
| ▸ | NOS1 | P29475 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL17887985 | 0.87 | RIPK1 (0.54) | GAARIPK1AOC3TSHRRECQL | |
| SCHEMBL17887629 | 0.82 | RIPK1 (0.58) | GAARIPK1AOC3TSHRRECQL | |
| SCHEMBL7320187 | 0.81 | NPC1 (0.52) | GAARIPK1AOC3TSHR | |
| SCHEMBL7320175 | 0.81 | NPC1 (0.52) | GAARIPK1AOC3TSHR | |
| Hydrochloric Acid SCHEMBL9555744 | 0.80 | NPC1 (0.50) | GAARIPK1AOC3TSHR | |
| Hydrochloric Acid SCHEMBL9555748 | 0.80 | NPC1 (0.50) | GAARIPK1AOC3TSHR | |
| SCHEMBL14344795 | 0.77 | RIPK1 (0.56) | GAARIPK1AOC3TSHRRECQL | |
| SCHEMBL9824208 | 0.77 | RIPK1 (0.64) | GAARIPK1AOC3TSHRRECQL | |
| SCHEMBL11746708 | 0.75 | AOC3 (0.68) | GAARIPK1AOC3TSHRRECQL | |
| SCHEMBL8290710 | 0.75 | TAAR1 (0.66) | GAARIPK1AOC3TSHRRECQL |
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 |