Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK4 | Q16654 | 1/20 | 0.46 |
| ▸ | HTR6 | P50406 | 1/20 | 0.45 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.44 |
| ▸ | GRM1 | Q13255 | 10/20 | 0.43 |
| ▸ | GRM5 | P41594 | 9/20 | 0.43 |
| ▸ | EED | O75530 | 1/20 | 0.41 |
| ▸ | RBBP4 | Q09028 | 1/20 | 0.41 |
| ▸ | SUZ12 | Q15022 | 1/20 | 0.41 |
| ▸ | EZH2 | Q15910 | 1/20 | 0.41 |
| ▸ | WNT3A | P56704 | 1/20 | 0.40 |
| ▸ | BRD4 | O60885 | 1/20 | 0.39 |
| ▸ | DGAT2 | Q96PD7 | 1/20 | 0.39 |
| ▸ | GABRP | O00591 | 1/20 | 0.38 |
| ▸ | GABRD | O14764 | 1/20 | 0.38 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.38 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.38 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.38 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.38 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.38 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL1762832 | 0.84 | PDK4 (0.49) | PDK4HTR6SCN9AGRM1GRM5 | |
| SCHEMBL5798518 | 0.81 | ALDH1A1 (0.43) | SCN9A | |
| SCHEMBL1762815 | 0.79 | GABRP (0.54) | PDK4HTR6GRM1GRM5EED | |
| SCHEMBL18409265 | 0.70 | GRM1 (0.52) | PDK4GRM1GRM5WNT3A | |
| SCHEMBL14540703 | 0.69 | HTR6 (0.70) | PDK4HTR6SCN9AGRM1GRM5 | |
| SCHEMBL18409268 | 0.68 | GRM1 (0.52) | PDK4GRM1GRM5WNT3A | |
| SCHEMBL8026743 | 0.67 | HTR6 (0.67) | PDK4HTR6SCN9AGRM1GRM5 | |
| SCHEMBL20030944 | 0.67 | SCN9A (0.49) | PDK4HTR6SCN9AGRM1GRM5 | |
| SCHEMBL19092559 | 0.67 | PDK4 (0.58) | PDK4HTR6SCN9AGRM1GRM5 | |
| SCHEMBL15167555 | 0.66 | GRM1 (0.57) | PDK4HTR6GRM1GRM5WNT3A |
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-2006042102-A2 | PYRROLO-PYRIDINE, PYRROLO-PYRIMIDINE AND RELATED HETEROCYCLIC COMPOUNDS | NEUROGEN CORPORATION (US) | 2006-04-20 | — | — | WO | disclosed |