Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 2/20 | 0.45 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.44 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.43 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.43 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.43 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.43 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.43 |
| ▸ | EGLN1 | Q9GZT9 | 2/20 | 0.42 |
| ▸ | VEGFA | P15692 | 1/20 | 0.42 |
| ▸ | XDH | P47989 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.39 |
| ▸ | PRKACA | P17612 | 1/20 | 0.39 |
| ▸ | PRKACG | P22612 | 1/20 | 0.39 |
| ▸ | PRKACB | P22694 | 1/20 | 0.39 |
| ▸ | CAMK2D | Q13557 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL15118465 | 0.80 | EGLN1 (0.50) | EGLN1VEGFAKMT2AMMP2MMP9 | |
| SCHEMBL18379365 | 0.77 | EGLN1 (0.37) | SIGMAR1EGLN1VEGFAKMT2AMMP2 | |
| SCHEMBL13475426 | 0.74 | KCNH2 (0.61) | HRH1 | |
| SCHEMBL13962027 | 0.73 | EGLN1 (0.50) | EGLN1VEGFAALDH1A1MMP2MMP9 | |
| SCHEMBL9453852 | 0.73 | ALDH1A1 (0.54) | EGLN1VEGFAALDH1A1MMP2MMP9 | |
| SCHEMBL29299526 | 0.72 | EGLN1 (0.47) | EGLN1VEGFAKMT2AMEN1MMP2 | |
| SCHEMBL16088173 | 0.72 | ALDH1A1 (0.49) | EGLN1VEGFAKMT2AALDH1A1MEN1 | |
| SCHEMBL8057138 | 0.71 | DRD3 (0.58) | SIGMAR1 | |
| SCHEMBL31041845 | 0.71 | ALDH1A1 (0.48) | EGLN1VEGFAKMT2AALDH1A1MEN1 | |
| SCHEMBL7256476 | 0.71 | EGLN1 (0.47) | EGLN1VEGFAKMT2AMEN1MAPT |
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-2010012811-A2 | METHOD FOR SCREENING OF 5HT7 RECEPTOR LIGANDS BASED ON A NEW PHARMACOPHORE MODEL AND A DESCRIPTOR'S PROFILE FILTER | LABORATORIOS DEL DR. ESTEVE, S.A. (ES) | 2010-02-04 | — | — | WO | disclosed |