Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | CNR2 | P34972 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.39 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.39 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.39 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.39 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.39 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.39 |
| ▸ | ACE | P12821 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.38 |
| ▸ | CTSL | P07711 | 1/20 | 0.37 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.37 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.37 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.37 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6793000 | 0.86 | FKBP1A (0.46) | CYP2C19ALDH1A1SIGMAR1NPSR1 | |
| SCHEMBL27712915 | 0.84 | SIGMAR1 (0.47) | KMT2ACYP2C19ALDH1A1LMNASIGMAR1 | |
| SCHEMBL1740752 | 0.84 | MEN1 (0.53) | KMT2AL3MBTL1ALDH1A1SIGMAR1MEN1 | |
| SCHEMBL8948803 | 0.82 | CYP2C19 (0.48) | KMT2ACYP2C19ALDH1A1SIGMAR1MEN1 | |
| Trifluoroacetic Acid SCHEMBL30867894 | 0.82 | FKBP1A (0.42) | CYP2C19CNR2ACE | |
| SCHEMBL30867774 | 0.82 | GRM6 (0.48) | KMT2ACYP2C19ALDH1A1LMNASIGMAR1 | |
| SCHEMBL2438024 | 0.82 | GRM6 (0.48) | KMT2ACYP2C19ALDH1A1LMNASIGMAR1 | |
| SCHEMBL28468245 | 0.81 | KMT2A (0.52) | KMT2AL3MBTL1CNR2ALDH1A1ACE | |
| SCHEMBL8315197 | 0.81 | CHRM2 (0.40) | KMT2AL3MBTL1CYP2C19SIGMAR1CHRM2 | |
| SCHEMBL31603848 | 0.81 | ALDH1A1 (0.47) | KMT2AL3MBTL1ALDH1A1LMNACHRM3 |
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 |
|---|---|---|---|---|---|---|---|
| US-5532255-A | Adhesion receptor antagonists | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1996-07-02 | — | — | US | disclosed |