Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LDHA | P00338 | 1/20 | 0.41 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.40 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.39 |
| ▸ | PPARA | Q07869 | 4/20 | 0.39 |
| ▸ | PPARD | Q03181 | 2/20 | 0.39 |
| ▸ | PPARG | P37231 | 1/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.39 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL20060472 | 0.89 | PTGER3 (0.42) | LDHAMTNR1AMTNR1BALOX15ALOX12 | |
| SCHEMBL20060485 | 0.86 | MTNR1A (0.40) | LDHAMTNR1AMTNR1BALOX15ALOX12 | |
| SCHEMBL20060650 | 0.85 | MTNR1A (0.42) | LDHAMTNR1AMTNR1BALOX15ALOX12 | |
| SCHEMBL20060471 | 0.84 | LDHA (0.41) | LDHAMTNR1AMTNR1BALOX15ALOX12 | |
| SCHEMBL15624586 | 0.82 | FOS (0.55) | ALOX15ALOX12ALDH1A1 | |
| SCHEMBL13748638 | 0.75 | ALOX15 (0.49) | ALOX15ALOX12PPARGAAK1KDM4E | |
| SCHEMBL7648467 | 0.74 | ALDH1A1 (0.52) | ALDH1A1 | |
| SCHEMBL15845242 | 0.74 | ALOX15 (0.60) | LDHAALOX15ALOX12SIGMAR1KDM4E | |
| SCHEMBL20705409 | 0.72 | ACACB (0.41) | PPARAPPARGAAK1 | |
| SCHEMBL27512606 | 0.72 | PPARA (0.49) | LDHAALOX15ALOX12PPARAPPARD |
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-1701949-B1 | ASSAY FOR ENTACTOGENS | SIEMENS HEALTHCARE DIAGNOSTICS INC (US) | 2018-04-18 | — | — | EP | disclosed |