Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR8 | Q9NR97 | 12/20 | 0.38 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.33 |
| ▸ | CNR2 | P34972 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | OXER1 | Q8TDS5 | 1/20 | 0.31 |
| ▸ | ICMT | O60725 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL1762786 | 0.78 | C5AR1 (0.31) | — | |
| SCHEMBL5796068 | 0.75 | TLR8 (0.40) | TLR8GLO1KDM4ENPC1ALDH1A1 | |
| SCHEMBL5798513 | 0.65 | CDK4 (0.38) | TLR8CNR2ICMT | |
| SCHEMBL2476855 | 0.64 | GRM2 (0.38) | GRM2CNR2SMN1; SMN2 | |
| SCHEMBL17304280 | 0.62 | LNPEP (0.46) | TLR8GRM2GLO1KDM4EALDH1A1 | |
| SCHEMBL17023237 | 0.62 | LMNA (0.45) | GRM2ALDH1A1SMN1; SMN2 | |
| SCHEMBL1328172 | 0.62 | C5AR1 (0.46) | — | |
| SCHEMBL201520 | 0.62 | ACACB (0.45) | GRM2CNR2ALDH1A1HPGDICMT | |
| SCHEMBL28990232 | 0.61 | BACE1 (0.46) | GRM2CNR2OXER1 | |
| SCHEMBL28990233 | 0.61 | OXER1 (0.46) | TLR8CNR2OXER1 |
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 |