Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 10/20 | 0.43 |
| ▸ | CHRNA4 | P43681 | 10/20 | 0.43 |
| ▸ | CHRNB4 | P30926 | 8/20 | 0.43 |
| ▸ | CHRNA3 | P32297 | 7/20 | 0.43 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL128591 | 0.79 | HCAR2 (0.45) | HCAR2NPSR1ALDH1A1MAPTLMNA | |
| SCHEMBL20028538 | 0.69 | MGAM (0.46) | CHRNB2CHRNA4CHRNB4CHRNA3ALDH1A1 | |
| SCHEMBL128754 | 0.69 | — | — | |
| SCHEMBL25585756 | 0.69 | HCAR2 (0.48) | CHRNB2CHRNA4CHRNB4CHRNA3HCAR2 | |
| SCHEMBL30929696 | 0.69 | HCAR2 (0.48) | CHRNB2CHRNA4CHRNB4CHRNA3HCAR2 | |
| SCHEMBL25537052 | 0.69 | HCAR2 (0.48) | CHRNB2CHRNA4CHRNB4CHRNA3HCAR2 | |
| SCHEMBL25537058 | 0.69 | HCAR2 (0.48) | CHRNB2CHRNA4CHRNB4CHRNA3HCAR2 | |
| SCHEMBL127141 | 0.68 | HCAR2 (0.42) | HCAR2NPSR1ALDH1A1MAPTLMNA | |
| SCHEMBL1260437 | 0.68 | — | — | |
| SCHEMBL196972 | 0.66 | ALDH1A1 (0.43) | CHRNB2CHRNA4CHRNB4CHRNA3ALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0823908-A1 | PYRIDO 2,3-d]PYRIMIDINES FOR INHIBITING PROTEIN TYROSINE KINASE MEDIATED CELLULAR PROLIFERATION | WARNER-LAMBERT COMPANY (US) | 1998-02-18 | — | — | EP | disclosed |
| WO-1996034867-A1 | PYRIDO[2,3-d]PYRIMIDINES FOR INHIBITING PROTEIN TYROSINE KINASE MEDIATED CELLULAR PROLIFERATION | WARNER-LAMBERT COMPANY (US) | 1996-11-07 | — | — | WO | disclosed |