Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.39 |
| ▸ | IDO1 | P14902 | 2/20 | 0.38 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.38 |
| ▸ | CSNK1E | P49674 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.38 |
| ▸ | PBK | Q96KB5 | 4/20 | 0.37 |
| ▸ | CYP3A5 | P20815 | 3/20 | 0.35 |
| ▸ | HTT | P42858 | 2/20 | 0.34 |
| ▸ | NOS3 | P29474 | 2/20 | 0.34 |
| ▸ | NOS1 | P29475 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | CDC7 | O00311 | 1/20 | 0.33 |
| ▸ | DBF4 | Q9UBU7 | 1/20 | 0.33 |
| ▸ | AXL | P30530 | 1/20 | 0.33 |
| ▸ | TYRO3 | Q06418 | 1/20 | 0.33 |
| ▸ | MERTK | Q12866 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL21372855 | 0.88 | CYP3A4 (0.44) | IDO1CYP3A4PBKCYP3A5NOS1 | |
| SCHEMBL21372664 | 0.87 | ALDH1A1 (0.47) | IDO1CYP3A4PBKCYP3A5HTT | |
| SCHEMBL21373009 | 0.87 | HTT (0.40) | IDO1CYP3A4PBKCYP3A5HTT | |
| SCHEMBL21372840 | 0.84 | IDO1 (0.57) | IDO1 | |
| SCHEMBL21373020 | 0.84 | IDO1 (0.38) | MKNK1IDO1CSNK1DCSNK1ECYP3A4 | |
| SCHEMBL21372731 | 0.83 | EIF2AK2 (0.41) | IDO1CYP3A4PBKNOS3NOS1 | |
| SCHEMBL21372682 | 0.83 | IDO1 (0.52) | IDO1 | |
| SCHEMBL21372804 | 0.83 | IDO1 (0.38) | IDO1CYP3A4PBKCYP3A5 | |
| SCHEMBL21372927 | 0.82 | IDO1 (0.47) | IDO1 | |
| SCHEMBL21373095 | 0.81 | IDO1 (0.39) | IDO1CYP3A4PBK |
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 |
|---|---|---|---|---|---|---|---|
| EP-3294732-B1 | BENZIMIDAZOLE AND IMADAZOPYRIDINE CARBOXIMIDAMIDE COMPOUNDS HAVING ACTIVITY AS INHIBITORS OF INDOLEAMINE 2,3-DIOXYGENASE | GILEAD SCIENCES INC (US) | 2019-09-25 | — | — | EP | claimed |