Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR6 | P50406 | 1/20 | 0.33 |
| ▸ | HTR5A | P47898 | 1/20 | 0.32 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.31 |
| ▸ | DRD2 | P14416 | 1/20 | 0.31 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.31 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.31 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.31 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.31 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.31 |
| ▸ | HTR2A | P28223 | 1/20 | 0.31 |
| ▸ | HTR2C | P28335 | 1/20 | 0.31 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.31 |
| ▸ | HRH1 | P35367 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8030752 | 0.89 | BCHE (0.34) | HTR6SIGMAR1KDM4ELMNATP53 | |
| SCHEMBL5970701 | 0.85 | HTR6 (0.35) | HTR6SIGMAR1HTR2ARET | |
| SCHEMBL1539577 | 0.81 | HTR6 (0.50) | HTR6HTR5ASIGMAR1KDM4ELMNA | |
| SCHEMBL22452025 | 0.81 | HTR6 (0.50) | HTR6HTR5ASIGMAR1KDM4ELMNA | |
| SCHEMBL29646288 | 0.81 | HTR6 (0.50) | HTR6HTR5ASIGMAR1KDM4ELMNA | |
| Lithium SCHEMBL18173784 | 0.79 | HTR6 (0.49) | HTR6HTR5ASIGMAR1KDM4ELMNA | |
| SCHEMBL13718967 | 0.77 | HTR6 (0.35) | HTR6HTR2A | |
| SCHEMBL8359986 | 0.77 | HTR2A (0.44) | HTR6SLC6A2HTR2AHTR2CHRH1 | |
| SCHEMBL1028711 | 0.70 | HTR6 (0.47) | HTR6SIGMAR1KDM4ELMNATP53 | |
| SCHEMBL291732 | 0.70 | BRD4 (0.32) | HTR2ARET |
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 |
|---|---|---|---|---|---|---|---|
| EP-0986567-A1 | PURE ENANTIOMER METALLOCENE COMPLEXES AND THE PRODUCTION AND USE OF THE SAME | Ringwald, Markus (DE) | 2000-03-22 | — | — | EP | disclosed |
| WO-1998052956-A1 | PURE ENANTIOMER METALLOCENE COMPLEXES AND THE PRODUCTION AND USE OF THE SAME | RINGWALD MARKUS (DE) | 1998-11-26 | — | — | WO | disclosed |