Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 3/20 | 0.44 |
| ▸ | CNR1 | P21554 | 1/20 | 0.41 |
| ▸ | CNR2 | P34972 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | BCL2 | P10415 | 1/20 | 0.39 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.38 |
| ▸ | HTR2A | P28223 | 2/20 | 0.37 |
| ▸ | HTR2B | P41595 | 2/20 | 0.37 |
| ▸ | MGLL | Q99685 | 1/20 | 0.37 |
| ▸ | HTR2C | P28335 | 1/20 | 0.37 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.36 |
| ▸ | ACP3 | P15309 | 1/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | ADRA1A | P35348 | 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 | |
|---|---|---|---|---|
| SCHEMBL15045357 | 0.85 | CNR1 (0.47) | CNR1CNR2CYP1A2CYP2C19LMNA | |
| SCHEMBL1908507 | 0.85 | ENPP2 (0.47) | KIF11CNR1CNR2CYP1A2CYP2C19 | |
| SCHEMBL15504962 | 0.85 | MEN1 (0.40) | KIF11CNR1CNR2CYP1A2CYP2C19 | |
| SCHEMBL11066480 | 0.83 | KIF11 (0.46) | KIF11CYP1A2CYP2C19TP53BCL2 | |
| SCHEMBL30288253 | 0.82 | TAAR1 (0.59) | KIF11CYP1A2CYP2C19HTR2AHTR2C | |
| SCHEMBL11546915 | 0.80 | KIF11 (0.47) | KIF11CNR1CNR2CYP1A2CYP2C19 | |
| SCHEMBL21277730 | 0.80 | TAAR1 (0.57) | KIF11CYP1A2CYP2C19TP53HTR2A | |
| SCHEMBL23773724 | 0.79 | HDAC8 (0.47) | KIF11CNR1CNR2MAPTMEN1 | |
| SCHEMBL129592 | 0.79 | KIF11 (0.46) | KIF11CYP1A2CYP2C19TP53BCL2 | |
| SCHEMBL1653927 | 0.79 | KIF11 (0.49) | KIF11CYP1A2CYP2C19TP53HTR2A |
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-8093406-B2 | Cyclic sulfones with aminobenzyl substitution useful as BACE inhibitors | NOVARTIS AG (CH) | 2012-01-10 | — | — | US | disclosed |