Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 10/20 | 0.64 |
| ▸ | ADRA1D | P25100 | 10/20 | 0.64 |
| ▸ | ADRA1A | P35348 | 10/20 | 0.64 |
| ▸ | ADRA1B | P35368 | 10/20 | 0.64 |
| ▸ | DRD4 | P21917 | 3/20 | 0.60 |
| ▸ | DRD2 | P14416 | 2/20 | 0.60 |
| ▸ | DRD3 | P35462 | 2/20 | 0.60 |
| ▸ | BCHE | P06276 | 2/20 | 0.57 |
| ▸ | SCN8A | Q9UQD0 | 1/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.53 |
| ▸ | MEN1 | O00255 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL2909008 | 0.88 | HTR1A (0.74) | HTR1AADRA1DADRA1AADRA1BDRD4 | |
| Hydrochloric Acid SCHEMBL8159235 | 0.86 | HTR1A (0.72) | HTR1AADRA1DADRA1AADRA1BDRD4 | |
| Ammonia Solution, Strong SCHEMBL2906266 | 0.86 | HTR1A (0.72) | HTR1AADRA1DADRA1AADRA1BDRD4 | |
| Bromide SCHEMBL9548125 | 0.86 | HTR1A (0.72) | HTR1AADRA1DADRA1AADRA1BDRD4 | |
| SCHEMBL11701339 | 0.82 | DRD4 (0.77) | HTR1AADRA1DADRA1AADRA1BDRD4 | |
| SCHEMBL11571903 | 0.79 | BCHE (0.66) | BCHEKDM4EKMT2A | |
| SCHEMBL7394364 | 0.79 | HTR1A (0.75) | HTR1AADRA1DADRA1AADRA1BDRD4 | |
| SCHEMBL8008739 | 0.78 | DRD4 (0.67) | HTR1AADRA1DADRA1AADRA1BDRD4 | |
| SCHEMBL8879501 | 0.77 | BCHE (0.78) | BCHEKDM4EMEN1KMT2A | |
| SCHEMBL11711163 | 0.77 | HTR1A (0.58) | HTR1AADRA1DADRA1AADRA1BDRD4 |
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-1995029155-A1 | NOVEL ANTITUMOUR COMPOUNDS WITH ANTIMITOTIC ACTIVITY | PHARMACIA AB (SE) | 1995-11-02 | — | — | WO | disclosed |