Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR8 | Q9NR97 | 11/20 | 0.40 |
| ▸ | LNPEP | Q9UIQ6 | 1/20 | 0.39 |
| ▸ | CDK4 | P11802 | 2/20 | 0.38 |
| ▸ | CCND1 | P24385 | 2/20 | 0.38 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | ICMT | O60725 | 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 | |
|---|---|---|---|---|
| SCHEMBL1762636 | 0.82 | RORC (0.42) | KDM4ELMNAMAPTHTTALDH1A1 | |
| SCHEMBL1762851 | 0.78 | HDAC3 (0.41) | SMN1; SMN2LMNAMAPTHTTNPC1 | |
| SCHEMBL1762620 | 0.78 | CYP11B1 (0.40) | NPC1ALDH1A1 | |
| SCHEMBL1762843 | 0.77 | MEN1 (0.41) | LMNAMAPTALDH1A1 | |
| SCHEMBL1762595 | 0.76 | TP53 (0.41) | SMN1; SMN2MAPTALDH1A1HPGD | |
| SCHEMBL1762581 | 0.76 | PDE1C (0.39) | KDM4EALDH1A1 | |
| SCHEMBL1762908 | 0.76 | KMT2A (0.39) | MAPTHPGD | |
| SCHEMBL1762705 | 0.76 | LMNA (0.42) | KDM4ESMN1; SMN2LMNAHTTALDH1A1 | |
| SCHEMBL5798513 | 0.75 | CDK4 (0.38) | TLR8LNPEPCDK4CCND1ICMT | |
| SCHEMBL1762713 | 0.75 | DGAT1 (0.42) | LMNAMAPTALDH1A1HPGD |
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 |