Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 4/20 | 0.43 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.39 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.38 |
| ▸ | MAOA | P21397 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | HTR1A | P08908 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.38 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.38 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | HTR2C | P28335 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7651165 | 1.00 | TAAR1 (0.43) | TAAR1AKR1B1SMN1; SMN2SLC6A4ADRA2A | |
| SCHEMBL2511832 | 0.81 | TAAR1 (0.50) | TAAR1AKR1B1SMN1; SMN2SLC6A4ADRA2A | |
| SCHEMBL29168048 | 0.79 | PNMT (0.53) | TAAR1SLC6A4CYP3A4CYP2D6LMNA | |
| SCHEMBL8790684 | 0.78 | TAAR1 (0.46) | TAAR1AKR1B1SMN1; SMN2SLC6A4ADRA2A | |
| SCHEMBL28108558 | 0.78 | PNMT (0.48) | TAAR1SMN1; SMN2SLC6A4CYP3A4CYP2D6 | |
| SCHEMBL3128931 | 0.78 | PNMT (0.48) | TAAR1SMN1; SMN2SLC6A4CYP3A4CYP2D6 | |
| SCHEMBL5181445 | 0.78 | PNMT (0.48) | TAAR1SMN1; SMN2SLC6A4CYP3A4CYP2D6 | |
| SCHEMBL10325433 | 0.77 | AKR1B1 (0.42) | TAAR1AKR1B1SMN1; SMN2SLC6A4ADRA2A | |
| SCHEMBL16054505 | 0.77 | AKR1B1 (0.42) | TAAR1AKR1B1SMN1; SMN2SLC6A4ADRA2A | |
| Hydrochloric Acid SCHEMBL17045213 | 0.76 | PNMT (0.47) | TAAR1SMN1; SMN2SLC6A4CYP2D6LMNA |
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-6489331-B1 | A CONDENSED PURINE DERIVATIVE AS AN ACTIVE INGREDIENT AS AN ENHANCER OF INSULIN SECRETION AND A MEDICAMENT FOR THE TREATMENT OF DIABETES | KYOWA HAKKO KOGYO CO., LTD. (JP) | 2002-12-03 | — | — | US | disclosed |
| EP-1092435-A1 | REMEDIES FOR DIABETES | KYOWA HAKKO KOGYO CO., LTD. (JP) | 2001-04-18 | — | — | EP | disclosed |