Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 1/20 | 0.47 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.40 |
| ▸ | HTR1A | P08908 | 1/20 | 0.40 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.40 |
| ▸ | DRD1 | P21728 | 1/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.40 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.40 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.40 |
| ▸ | DRD3 | P35462 | 1/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | BCHE | P06276 | 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 | |
|---|---|---|---|---|
| SCHEMBL18494830 | 0.96 | HSD11B1 (0.43) | HTR2ACA1CA2HSD11B1ALDH1A1 | |
| SCHEMBL17986526 | 0.94 | HTR2A (0.55) | HTR2AKCNH2HSD11B1CHRM2ADRA2A | |
| SCHEMBL25907712 | 0.89 | UCHL3 (0.45) | HTR2ACA1CA2ALDH1A1HPGD | |
| SCHEMBL12018269 | 0.89 | UCHL3 (0.45) | HTR2ACA1CA2ALDH1A1HPGD | |
| SCHEMBL15854779 | 0.88 | CA1 (0.40) | HTR2AKCNH2CA1CA2ALDH1A1 | |
| SCHEMBL13474932 | 0.87 | NPC1 (0.41) | HTR2ACA1CA2ALDH1A1HPGD | |
| SCHEMBL14292089 | 0.87 | GPR88 (0.41) | HTR2ASIGMAR1 | |
| SCHEMBL13474954 | 0.85 | SMN1; SMN2 (0.43) | CA1CA2ALDH1A1HPGD | |
| SCHEMBL10042891 | 0.85 | KCNH2 (0.52) | HTR2AKCNH2CA1CA2HSD11B1 | |
| SCHEMBL987390 | 0.85 | KCNH2 (0.52) | HTR2AKCNH2CA1CA2HSD11B1 |
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 |
|---|---|---|---|---|---|---|---|
| US-7666956-B2 | Polymer | MERCK PATENT GMBH (DE) | 2010-02-23 | — | — | US | disclosed |
| US-7666956-B2 | Polymer | MERCK PATENT GMBH (DE) | 2010-02-23 | — | — | US | disclosed |