Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DAO | P14920 | 8/20 | 0.70 |
| ▸ | DDO | Q99489 | 4/20 | 0.70 |
| ▸ | HTR2C | P28335 | 5/20 | 0.44 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.43 |
| ▸ | HTR2A | P28223 | 3/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.41 |
| ▸ | HTR1D | P28221 | 2/20 | 0.41 |
| ▸ | HTR1B | P28222 | 2/20 | 0.41 |
| ▸ | HTR7 | P34969 | 2/20 | 0.41 |
| ▸ | HTR6 | P50406 | 2/20 | 0.41 |
| ▸ | MPO | P05164 | 1/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.41 |
| ▸ | CTSK | P43235 | 1/20 | 0.41 |
| ▸ | CYP2A13 | Q16696 | 1/20 | 0.41 |
| ▸ | RECQL | P46063 | 2/20 | 0.41 |
| ▸ | HTR1A | P08908 | 2/20 | 0.41 |
| ▸ | HTR2B | P41595 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL16767853 | 0.83 | DAO (1.00) | DAODDOMAPTKDM4EALDH1A1 | |
| SCHEMBL15713795 | 0.78 | DAO (0.68) | DAODDOCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL3363456 | 0.76 | DAO (1.00) | DAODDOMAPTKDM4EALDH1A1 | |
| Trifluoroacetic Acid SCHEMBL30355134 | 0.73 | DAO (0.44) | DAODDOHTR2CHTR1DHTR1B | |
| SCHEMBL3423807 | 0.72 | DAO (1.00) | DAODDOCYP1A2MAPTKDM4E | |
| SCHEMBL16767849 | 0.72 | DAO (1.00) | DAODDOCYP1A2TSHRMEN1 | |
| SCHEMBL15690473 | 0.72 | DAO (0.65) | DAODDOCYP1A2MEN1BLM | |
| SCHEMBL15713792 | 0.72 | DAO (0.59) | DAODDOKDM4E | |
| SCHEMBL9549950 | 0.71 | ALDH1A1 (0.56) | HTR2CTAAR1HTR2ACYP1A2CYP3A4 | |
| SCHEMBL29281062 | 0.70 | TAAR1 (0.52) | HTR2CTAAR1CYP2D6RECQLHTR1A |
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 |
|---|---|---|---|---|---|---|---|
| EP-0125052-A2 | Dopaminergic carbostyrils and a process for preparing them | SMITHKLINE BECKMAN CORPORATION (US) | 1984-11-14 | — | — | EP | claimed |