Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.55 |
| ▸ | DRD4 | P21917 | 3/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.55 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.55 |
| ▸ | USP2 | O75604 | 1/20 | 0.55 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.55 |
| ▸ | LMNA | P02545 | 1/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.55 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.55 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.55 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.55 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.55 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.55 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.55 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.55 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.55 |
| ▸ | DRD1 | P21728 | 1/20 | 0.55 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.55 |
| ▸ | HRH2 | P25021 | 1/20 | 0.55 |
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 SCHEMBL8092726 | 0.99 | KDM4E (0.56) | ALDH1A1DRD4CYP2C19SIGMAR1USP2 | |
| Hydrochloric Acid SCHEMBL8089203 | 0.84 | NPSR1 (0.42) | ALDH1A1DRD4CYP2C19SIGMAR1USP2 | |
| SCHEMBL8800644 | 0.82 | CA2 (0.48) | ALDH1A1DRD4CYP2C19SIGMAR1USP2 | |
| SCHEMBL11559591 | 0.80 | CYP1A2 (0.51) | ALDH1A1DRD4CYP2C19SIGMAR1USP2 | |
| Hydrochloric Acid SCHEMBL8094716 | 0.78 | ACHE (0.47) | ALDH1A1SIGMAR1LMNAKDM4ETSHR | |
| SCHEMBL11544067 | 0.78 | TSHR (0.40) | ALDH1A1DRD4CYP2C19SIGMAR1USP2 | |
| Maleic Acid SCHEMBL8081050 | 0.76 | DRD4 (0.39) | ALDH1A1DRD4CYP2C19SIGMAR1LMNA | |
| SCHEMBL11562628 | 0.76 | ALDH1A1 (0.46) | ALDH1A1DRD4CYP2C19SIGMAR1USP2 | |
| SCHEMBL11621600 | 0.73 | ALDH1A1 (0.51) | ALDH1A1DRD4CYP2C19SIGMAR1USP2 | |
| SCHEMBL8800722 | 0.72 | ALDH1A1 (0.43) | ALDH1A1DRD4CYP2C19SIGMAR1USP2 |
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-0522956-B1 | Preparation of 2-(2-thienyl) ethylamine and synthesis of thieno [3,2-C] pyridine derivatives therefrom | SANOFI SA (FR) | 1997-02-05 | — | — | EP | disclosed |
| EP-0522956-A2 | Preparation of 2-(2-thienyl) ethylamine and synthesis of thieno [3,2-C] pyridine derivatives therefrom | SANOFI (FR) | 1993-01-13 | — | — | EP | disclosed |
| US-4127580-A | MULTISTAGE | PARCOR (FR) | 1978-11-28 | — | — | US | disclosed |