Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.35 |
| ▸ | CA2 | P00918 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | TYR | P14679 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.32 |
| ▸ | HTR1A | P08908 | 2/20 | 0.32 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.32 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.32 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.32 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.32 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9869957 | 1.00 | CYP1A2 (0.35) | CYP1A2CYP2C19CYP2C9CA2ALDH1A1 | |
| Hydrochloric Acid SCHEMBL9871640 | 0.85 | LMNA (0.33) | CYP1A2CYP2C19CYP2C9CA2ALDH1A1 | |
| Hydrochloric Acid SCHEMBL9871635 | 0.85 | LMNA (0.33) | CYP1A2CYP2C19CYP2C9CA2ALDH1A1 | |
| SCHEMBL9820707 | 0.81 | CYP1A2 (0.37) | CYP1A2CYP2C19CYP2C9CA2ALDH1A1 | |
| SCHEMBL9820690 | 0.76 | MAOA (0.31) | KMT2A | |
| SCHEMBL9820696 | 0.76 | MAOA (0.31) | KMT2A | |
| SCHEMBL9820813 | 0.75 | MAOA (0.42) | ALDH1A1POLBLMNACYP2D6MEN1 | |
| SCHEMBL9820645 | 0.73 | MAOA (0.31) | — | |
| SCHEMBL9820650 | 0.73 | MAOA (0.31) | — | |
| Hydrochloric Acid SCHEMBL9870486 | 0.68 | CYP1A2 (0.35) | CYP1A2CYP2C19CYP2C9CA2ALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5017724-A | Antihypoxic, CNS | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1991-05-21 | — | — | US | disclosed |
| EP-0267024-A2 | Hydrofluorene derivatives | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1988-05-11 | — | — | EP | disclosed |