Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 3/20 | 0.36 |
| ▸ | CA2 | P00918 | 3/20 | 0.36 |
| ▸ | HTR6 | P50406 | 2/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.32 |
| ▸ | HTR1A | P08908 | 1/20 | 0.32 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.32 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.32 |
| ▸ | DRD1 | P21728 | 1/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.32 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.32 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.32 |
| ▸ | DRD3 | P35462 | 1/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL21765759 | 0.76 | CA1 (0.52) | CA1CA2HTR6CHRM2HTR1A | |
| SCHEMBL13765095 | 0.72 | — | — | |
| SCHEMBL26407841 | 0.65 | KDM4E (0.47) | CA1CA2ALDH1A1TSHRMEN1 | |
| SCHEMBL22641966 | 0.63 | ALDH1A1 (0.34) | ALDH1A1 | |
| SCHEMBL23950560 | 0.62 | ALDH1A1 (0.36) | ALDH1A1 | |
| SCHEMBL14900028 | 0.62 | PIM1 (0.35) | SIGMAR1 | |
| SCHEMBL23544317 | 0.62 | HTR6 (0.34) | CA1CA2HTR6CHRM2HTR1A | |
| SCHEMBL21896603 | 0.61 | — | — | |
| SCHEMBL26481780 | 0.60 | MGLL (0.36) | HTR6HTR1AALDH1A1 | |
| SCHEMBL25790623 | 0.60 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3171421-A1 | ORGANIC LIGHT-EMITTING ELEMENT | Kyushu University, National University Corporation (JP) | 2017-05-24 | — | — | EP | disclosed |