Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NISCH | Q9Y2I1 | 15/20 | 0.87 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.49 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.49 |
| ▸ | HTR1A | P08908 | 1/20 | 0.49 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.49 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.49 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.49 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.47 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL9575177 | 0.93 | NISCH (1.00) | NISCHMAPK1TAAR1CYP2D6LMNA | |
| SCHEMBL8197228 | 0.84 | NISCH (0.77) | NISCHLMNACYP1A2ALDH1A1 | |
| SCHEMBL9579892 | 0.84 | NISCH (0.81) | NISCH | |
| SCHEMBL8201347 | 0.81 | NISCH (0.72) | NISCH | |
| SCHEMBL4815704 | 0.80 | NISCH (0.70) | NISCHMAPK1TAAR1CYP2D6LMNA | |
| SCHEMBL4822940 | 0.80 | NISCH (0.70) | NISCHMAPK1TAAR1CYP2D6LMNA | |
| SCHEMBL16863098 | 0.80 | NISCH (0.76) | NISCH | |
| SCHEMBL11132092 | 0.78 | NISCH (0.74) | NISCHCYP2D6ADRA2AADRA2BADRA2C | |
| SCHEMBL3394014 | 0.76 | NISCH (0.65) | NISCH | |
| SCHEMBL4362741 | 0.76 | NISCH (0.63) | NISCHMAPK1TAAR1CYP2D6LMNA |
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-2000078726-A1 | IMIDAZOLINE DERIVATIVES FOR THE TREATMENT OF DIABETES, ESPECIALLY TYPE II DIABETES | ELI LILLY AND COMPANY (US) | 2000-12-28 | — | — | WO | disclosed |