Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | CTSC | P53634 | 7/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.40 |
| ▸ | DPP4 | P27487 | 1/20 | 0.39 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.39 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.39 |
| ▸ | ADRA2A | P08913 | 3/20 | 0.39 |
| ▸ | ADRA2B | P18089 | 3/20 | 0.39 |
| ▸ | ADRA2C | P18825 | 3/20 | 0.39 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.38 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.38 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL4668703 | 0.87 | CYP2C19 (0.50) | TAAR1CYP2C19RAB9ACTSCDPP4 | |
| SCHEMBL657170 | 0.86 | CYP2C19 (0.55) | TAAR1CYP2C19RAB9ACTSCDPP4 | |
| SCHEMBL9326082 | 0.83 | CYP2C19 (0.46) | TAAR1CYP2C19RAB9ACTSCDPP4 | |
| SCHEMBL20967774 | 0.79 | TAAR1 (0.52) | TAAR1CYP2C19RAB9ACTSCMAOB | |
| SCHEMBL1425381 | 0.78 | CYP2C19 (0.48) | TAAR1CYP2C19RAB9ACTSCADRA2A | |
| SCHEMBL12262584 | 0.78 | CYP2C19 (0.48) | TAAR1CYP2C19RAB9ACTSCADRA2A | |
| SCHEMBL14860743 | 0.78 | CYP2C19 (0.53) | TAAR1CYP2C19RAB9ACTSCDPP4 | |
| SCHEMBL12262043 | 0.78 | CYP2C19 (0.48) | TAAR1CYP2C19RAB9ACTSCADRA2A | |
| SCHEMBL288839 | 0.78 | CYP2C19 (0.57) | CYP2C19RAB9ACTSCDPP4DPP8 | |
| SCHEMBL24017051 | 0.77 | CYP2C19 (0.55) | TAAR1CYP2C19RAB9ACTSCADRA2A |
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 |
|---|---|---|---|---|---|---|---|
| US-5068360-A | Preparation of 2-(2'-thienyl)ethylamine derivatives and synthesis of thieno(3,2-C)pyridine derivatives therefrom | SYNTEX (U.S.A.) INC. (US) | 1991-11-26 | — | — | US | disclosed |