Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR6 | P50406 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 2/20 | 0.32 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.31 |
| ▸ | BRD4 | O60885 | 1/20 | 0.30 |
| ▸ | CCL2 | P13500 | 1/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.30 |
| ▸ | DRD2 | P14416 | 1/20 | 0.30 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.30 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.30 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.30 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.30 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.30 |
| ▸ | HTR2C | P28335 | 1/20 | 0.30 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7100297 | 0.80 | HTR2A (0.33) | HTR6HTR2ASIGMAR1BRD4CCL2 | |
| SCHEMBL3383168 | 0.79 | HTR2A (0.35) | HTR6HTR2ASIGMAR1BRD4CCL2 | |
| SCHEMBL3834161 | 0.76 | SIGMAR1 (0.35) | HTR6HTR2ASIGMAR1 | |
| SCHEMBL215792 | 0.76 | HTR2A (0.35) | HTR6HTR2A | |
| SCHEMBL7951352 | 0.76 | HTR2A (0.35) | HTR6HTR2ASIGMAR1 | |
| SCHEMBL15283338 | 0.75 | HTR2A (0.36) | HTR6HTR2ASIGMAR1BRD4CCL2 | |
| Hydrochloric Acid SCHEMBL7107339 | 0.75 | KDM4E (0.33) | HTR6HTR2ASIGMAR1BRD4CCL2 | |
| SCHEMBL216950 | 0.75 | HTR6 (0.33) | HTR6HTR2ASIGMAR1BRD4CCL2 | |
| SCHEMBL217218 | 0.75 | HTR6 (0.33) | HTR6HTR2ASIGMAR1BRD4CCL2 | |
| SCHEMBL4479589 | 0.75 | HTR6 (0.33) | HTR6HTR2ASIGMAR1BRD4CCL2 |
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 |
|---|---|---|---|---|---|---|---|
| US-6420297-B2 | PENDANT BORON BASED LEWIS ACID GROUPS; INCREASED ACTIVITY | UNIVATION TECHNOLOGIES, LLC | 2002-07-16 | — | — | US | disclosed |