Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NISCH | Q9Y2I1 | 12/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.51 |
| ▸ | USP2 | O75604 | 1/20 | 0.51 |
| ▸ | POLB | P06746 | 1/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.51 |
| ▸ | RECQL | P46063 | 1/20 | 0.51 |
| ▸ | BLM | P54132 | 1/20 | 0.51 |
| ▸ | UBE2N | P61088 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | FTO | Q9C0B1 | 1/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.51 |
| ▸ | HPGD | P15428 | 2/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | ADRA2A | P08913 | 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 | |
|---|---|---|---|---|
| SCHEMBL8198114 | 0.89 | NISCH (0.54) | NISCHALDH1A1CYP1A2HSD17B10CYP2D6 | |
| SCHEMBL8194569 | 0.89 | NISCH (0.56) | NISCHALDH1A1CYP1A2HSD17B10CYP2D6 | |
| Hydrochloric Acid SCHEMBL7736746 | 0.88 | NISCH (0.62) | NISCHALDH1A1CYP1A2HSD17B10CYP2D6 | |
| SCHEMBL8196630 | 0.86 | NISCH (0.53) | NISCHALDH1A1CYP1A2HSD17B10CYP2D6 | |
| SCHEMBL8199412 | 0.85 | NISCH (0.52) | NISCHALDH1A1CYP1A2HSD17B10CYP2D6 | |
| SCHEMBL8200670 | 0.84 | NISCH (0.53) | NISCHALDH1A1CYP1A2HSD17B10CYP2D6 | |
| Hydrochloric Acid SCHEMBL8199821 | 0.82 | NISCH (0.50) | NISCHALDH1A1CYP1A2HSD17B10CYP2D6 | |
| Hydrochloric Acid SCHEMBL8188726 | 0.82 | NISCH (0.50) | NISCHALDH1A1CYP1A2HSD17B10CYP2D6 | |
| SCHEMBL8201878 | 0.82 | NISCH (0.51) | NISCHALDH1A1CYP1A2HSD17B10CYP2D6 | |
| SCHEMBL8198751 | 0.82 | NISCH (0.54) | NISCHALDH1A1CYP1A2HSD17B10CYP2D6 |
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 |