Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR6 | P50406 | 3/20 | 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 |
| ▸ | DRD3 | P35462 | 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 | |
|---|---|---|---|---|
| SCHEMBL1538530 | 0.80 | HTR2A (0.36) | HTR6SIGMAR1KDM4ELMNATP53 | |
| Hydrochloric Acid SCHEMBL4089820 | 0.79 | HTR6 (0.33) | HTR6SIGMAR1KDM4EMEN1PMP22 | |
| Hydrochloric Acid SCHEMBL4089813 | 0.70 | KDM4E (0.34) | HTR6SIGMAR1KDM4ELMNATP53 | |
| SCHEMBL7935490 | 0.69 | HTR2A (0.33) | SIGMAR1KDM4ELMNATP53CHRM2 | |
| Hydrochloric Acid SCHEMBL4089815 | 0.69 | HTR6 (0.33) | HTR6SIGMAR1KDM4ELMNATP53 | |
| Hydrochloric Acid SCHEMBL3769980 | 0.69 | HTR6 (0.33) | HTR6SIGMAR1KDM4ELMNATP53 | |
| Hydrochloric Acid SCHEMBL3770251 | 0.69 | SIGMAR1 (0.34) | HTR6SIGMAR1KDM4ELMNATP53 | |
| Hydrochloric Acid SCHEMBL966779 | 0.69 | HTR6 (0.33) | HTR6SIGMAR1KDM4ELMNATP53 | |
| SCHEMBL4465783 | 0.67 | HTR2A (0.35) | HTR6SIGMAR1HTR2A | |
| SCHEMBL5872694 | 0.66 | CYP2A6 (0.33) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009104785-A1 | CATALYST COMPONENT FOR POLYMERIZATION OF ETHYLENE AND PROCESS FOR PRODUCING ETHYLENE POLYMER (1) | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2009-08-27 | — | — | WO | disclosed |