Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 4/20 | 0.52 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.52 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.52 |
| ▸ | GABRB2 | P47870 | 3/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.41 |
| ▸ | HPGD | P15428 | 3/20 | 0.41 |
| ▸ | TSHR | P16473 | 3/20 | 0.41 |
| ▸ | FAAH | O00519 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.41 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.41 |
| ▸ | HTR2C | P28335 | 1/20 | 0.41 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.41 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.41 |
| ▸ | HTR2B | P41595 | 1/20 | 0.41 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL18469082 | 0.84 | GABRA1 (0.62) | GABRA1GABRG2GABRB3GABRB2CYP1A2 | |
| SCHEMBL16952660 | 0.84 | GABRA1 (0.35) | GABRA1GABRG2GABRB3GABRB2CYP1A2 | |
| SCHEMBL19289752 | 0.81 | GABRA1 (0.46) | GABRA1GABRG2GABRB3GABRB2CYP1A2 | |
| SCHEMBL1293277 | 0.79 | GABRA1 (0.48) | GABRA1GABRB2CYP1A2TSHRTAAR1 | |
| SCHEMBL1293421 | 0.79 | GABRA1 (0.38) | GABRA1GABRG2GABRB3GABRB2CYP3A4 | |
| SCHEMBL16956016 | 0.77 | GABRA1 (0.32) | GABRA1GABRB2 | |
| SCHEMBL31737293 | 0.77 | GABRA1 (0.50) | GABRA1GABRG2GABRB3GABRB2CYP1A2 | |
| SCHEMBL9734713 | 0.77 | GABRA1 (0.54) | GABRA1GABRG2GABRB3GABRB2CYP1A2 | |
| SCHEMBL3417547 | 0.77 | GABRA1 (0.54) | GABRA1GABRG2GABRB3GABRB2CYP1A2 | |
| SCHEMBL9579249 | 0.77 | GABRA1 (0.54) | GABRA1GABRG2GABRB3GABRB2CYP1A2 |
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-2021108198-A1 | INHIBITORS OF RECEPTOR INTERACTING PROTEIN KINASE I FOR THE TREATMENT OF DISEASE | BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) | 2021-06-03 | — | — | WO | disclosed |