Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGLN2 | Q96KS0 | 1/20 | 0.42 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.40 |
| ▸ | GRIA1 | P42261 | 1/20 | 0.40 |
| ▸ | GRIA2 | P42262 | 1/20 | 0.40 |
| ▸ | GRIA3 | P42263 | 1/20 | 0.40 |
| ▸ | GRIA4 | P48058 | 1/20 | 0.40 |
| ▸ | GRIK2 | Q13002 | 1/20 | 0.40 |
| ▸ | GRIK3 | Q13003 | 1/20 | 0.40 |
| ▸ | GRIK4 | Q16099 | 1/20 | 0.40 |
| ▸ | GRIK5 | Q16478 | 1/20 | 0.40 |
| ▸ | TIPARP | Q7Z3E1 | 3/20 | 0.39 |
| ▸ | PDE3B | Q13370 | 4/20 | 0.38 |
| ▸ | PDE3A | Q14432 | 4/20 | 0.38 |
| ▸ | IDO1 | P14902 | 1/20 | 0.37 |
| ▸ | TRPC5 | Q9UL62 | 1/20 | 0.36 |
| ▸ | PDE2A | O00408 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL16535460 | 0.73 | IDO1 (0.44) | EGLN2GRIK1GRIA1GRIA2GRIA3 | |
| SCHEMBL8213774 | 0.71 | CCNE1 (0.42) | PDE3BPDE3ACYP1A2CYP3A4CYP2D6 | |
| SCHEMBL28811546 | 0.69 | IDO1 (0.52) | IDO1CYP1A2CYP3A4GAACYP2D6 | |
| Hydrochloric Acid SCHEMBL8135556 | 0.69 | GRIA1 (0.60) | EGLN2GRIK1GRIA1GRIA2GRIA3 | |
| SCHEMBL25616990 | 0.68 | POLB (0.65) | TIPARPTRPC5POLB | |
| SCHEMBL25968360 | 0.68 | EGLN2 (0.40) | EGLN2GRIK1GRIA1GRIA2GRIA3 | |
| SCHEMBL6207390 | 0.67 | PDE3B (0.49) | PDE3BPDE3AIDO1PDE2ACYP3A4 | |
| SCHEMBL25617696 | 0.66 | TIPARP (0.71) | TIPARPPDE3BPDE3ATRPC5POLB | |
| SCHEMBL25695016 | 0.66 | HTR7 (0.54) | TIPARPTRPC5POLB | |
| SCHEMBL29105016 | 0.65 | IDO1 (0.47) | EGLN2IDO1CYP1A2CYP3A4GAA |
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-2023150591-A2 | PYRIDAZINONE COMPOUNDS AS TRPA1 INHIBITORS | D.E. SHAW RESEARCH, LLC (US) | 2023-08-10 | — | — | WO | disclosed |