Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 10/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | HTR2A | P28223 | 4/20 | 0.40 |
| ▸ | HTR7 | P34969 | 1/20 | 0.40 |
| ▸ | HTR1D | P28221 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL3842079 | 0.84 | TAAR1 (0.56) | TAAR1HTR2AHTR7HTR1DSMN1; SMN2 | |
| SCHEMBL6404257 | 0.83 | ALDH1A1 (0.48) | TAAR1ALDH1A1CYP2A6CYP1A2LOXL2 | |
| SCHEMBL533804 | 0.81 | ALDH1A1 (0.46) | ALDH1A1CYP2A6CYP1A2 | |
| SCHEMBL10830808 | 0.81 | ALDH1A1 (0.46) | TAAR1ALDH1A1HTR1DCYP2A6CYP1A2 | |
| SCHEMBL533943 | 0.78 | ALDH1A1 (0.48) | ALDH1A1CYP2A6CYP1A2 | |
| SCHEMBL9045995 | 0.78 | ALDH1A1 (0.43) | TAAR1ALDH1A1CYP2A6CYP1A2 | |
| SCHEMBL23629145 | 0.77 | TAAR1 (0.48) | TAAR1ALDH1A1HTR2ASMN1; SMN2CYP2A6 | |
| SCHEMBL20558456 | 0.77 | TAAR1 (0.59) | TAAR1ALDH1A1HTR2ASMN1; SMN2NPSR1 | |
| SCHEMBL22520955 | 0.77 | TAAR1 (0.59) | TAAR1HTR2AHTR7HTR1DSMN1; SMN2 | |
| SCHEMBL6952951 | 0.77 | TAAR1 (0.65) | TAAR1HTR2AHTR7HTR1DSMN1; SMN2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1112998-B1 | AMINE DERIVATIVES | POLA CHEM IND INC (JP) | 2004-12-08 | — | — | EP | disclosed |
| US-6586633-B1 | Antifungal agents | POLA CHEMICAL INDUSTRIES, INC. (JP) | 2003-07-01 | — | — | US | disclosed |
| EP-1112998-A1 | AMINE DERIVATIVES | POLA CHEMICAL INDUSTRIES, INC. (JP) | 2001-07-04 | — | — | EP | disclosed |