Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 4/20 | 0.35 |
| ▸ | HTR7 | P34969 | 4/20 | 0.35 |
| ▸ | HTR2A | P28223 | 2/20 | 0.35 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.35 |
| ▸ | DRD2 | P14416 | 2/20 | 0.35 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.35 |
| ▸ | HRH1 | P35367 | 2/20 | 0.35 |
| ▸ | DRD3 | P35462 | 2/20 | 0.35 |
| ▸ | HTR2B | P41595 | 1/20 | 0.35 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.34 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.34 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL4040618 | 0.99 | HTR2C (0.35) | HTR2CHTR7HTR2AADRA2ADRD2 | |
| SCHEMBL4046594 | 0.94 | CYP1A2 (0.35) | HTR2CHTR7HTR2AADRA2ADRD2 | |
| Hydrochloric Acid SCHEMBL4039414 | 0.93 | CYP1A2 (0.34) | HTR2CHTR7HTR2AADRA2ADRD2 | |
| SCHEMBL4042515 | 0.90 | ALDH1A1 (0.37) | HTR2CHTR7HTR2AADRA2AHRH1 | |
| Hydrochloric Acid SCHEMBL4039575 | 0.89 | KDM4E (0.36) | HTR2CHTR7HTR2AADRA2AHRH1 | |
| SCHEMBL4037112 | 0.87 | HTR2A (0.38) | HTR2CHTR7HTR2AADRA2ADRD2 | |
| SCHEMBL5428745 | 0.86 | HDAC3 (0.33) | HTR7ADRB2ADRB1HDAC3HDAC1 | |
| SCHEMBL5421711 | 0.83 | KDM4E (0.34) | ADRB2ADRB1HDAC3HDAC1HDAC2 | |
| SCHEMBL4035884 | 0.83 | CACNA1H (0.36) | ADRA2ADRD3CYP1A2CYP2D6ALDH1A1 | |
| Hydrochloric Acid SCHEMBL6334027 | 0.83 | — | — |
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-1284977-B1 | THIENODIBENZOAZULENE COMPOUNDS AS TUMOR NECROSIS FACTOR INHIBITORS | GLAXOSMITHKLINE ZAGREB (HR) | 2009-06-24 | — | — | EP | claimed |