Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 4/20 | 0.62 |
| ▸ | ABCB1 | P08183 | 10/20 | 0.58 |
| ▸ | HTR1A | P08908 | 3/20 | 0.54 |
| ▸ | DRD2 | P14416 | 3/20 | 0.54 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL8342046 | 0.92 | TAAR1 (0.73) | TAAR1ABCB1HTR1ADRD2ADRA1A | |
| SCHEMBL8349999 | 0.85 | TAAR1 (0.79) | TAAR1ADRA1A | |
| SCHEMBL42400 | 0.79 | TAAR1 (1.00) | TAAR1 | |
| Ammonia Solution, Strong SCHEMBL28996261 | 0.78 | TAAR1 (0.96) | TAAR1 | |
| Hydrochloric Acid SCHEMBL10917318 | 0.78 | TAAR1 (0.96) | TAAR1 | |
| Hydrochloric Acid SCHEMBL19950932 | 0.76 | TAAR1 (0.93) | TAAR1 | |
| Hydrochloric Acid SCHEMBL7434492 | 0.76 | TAAR1 (0.69) | TAAR1ABCB1HTR1ADRD2ADRA1A | |
| SCHEMBL29350784 | 0.76 | TAAR1 (1.00) | TAAR1ADRA1A | |
| SCHEMBL305943 | 0.76 | TAAR1 (1.00) | TAAR1ADRA1A | |
| SCHEMBL8358294 | 0.76 | TAAR1 (0.78) | TAAR1ABCB1ADRA1A |
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 |
|---|---|---|---|---|---|---|---|
| WO-1998008839-A1 | COMBINATORIAL PROCESS FOR PREPARING SUBSTITUTED THIOPHENE LIBRARIES | ELI LILLY AND COMPANY (US) | 1998-03-05 | — | — | WO | disclosed |