Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.59 |
| ▸ | HTR1B | P28222 | 4/20 | 0.56 |
| ▸ | TAAR1 | Q96RJ0 | 5/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.53 |
| ▸ | LMNA | P02545 | 1/20 | 0.53 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.53 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.53 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.53 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.53 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.53 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.49 |
| ▸ | HTR1D | P28221 | 5/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | MAOA | P21397 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL11597510 | 0.80 | TAAR1 (0.79) | HTR1BTAAR1CYP2D6CYP1A2LMNA | |
| Hydrochloric Acid SCHEMBL11170308 | 0.79 | TAAR1 (0.80) | HTR1BTAAR1CYP2D6CYP1A2LMNA | |
| SCHEMBL21519443 | 0.76 | TAAR1 (0.81) | HTR1BTAAR1CYP2D6CYP1A2LMNA | |
| SCHEMBL7115844 | 0.75 | TAAR1 (0.56) | HTR1BTAAR1CYP2D6CYP1A2LMNA | |
| SCHEMBL7005260 | 0.74 | TAAR1 (0.58) | HTR1BTAAR1CYP2D6CYP1A2LMNA | |
| SCHEMBL21519534 | 0.73 | TAAR1 (0.56) | HTR1BTAAR1CYP2D6CYP1A2LMNA | |
| SCHEMBL7009355 | 0.73 | HTR1D (0.47) | HTR1BTAAR1CYP2D6CYP1A2LMNA | |
| SCHEMBL5827600 | 0.72 | HTR1B (0.68) | HTR1BTAAR1CYP2D6CYP1A2LMNA | |
| SCHEMBL14340604 | 0.72 | HTR1B (0.68) | HTR1BTAAR1CYP2D6CYP1A2LMNA | |
| SCHEMBL7009936 | 0.72 | HTR1D (0.43) | HTR1BTAAR1CYP2D6CYP1A2LMNA |
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-5070086-A | ANTIALLERGY, ANTIINFLAMMATORY, ANTIPSORIASIS | SCHERING CORPORATION (US) | 1991-12-03 | — | — | US | disclosed |
| EP-0325048-A1 | Imidazo- and pyrimido-quinoline, naphthyridine and pyridopyrazine compounds | SCHERING CORPORATION (US) | 1989-07-26 | — | — | EP | disclosed |