Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.50 |
| ▸ | MAOB | P27338 | 2/20 | 0.49 |
| ▸ | MAOA | P21397 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | F2 | P00734 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | HTR1A | P08908 | 1/20 | 0.43 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.43 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.43 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL928220 | 0.96 | TSHR (0.47) | TSHRMAOBMAOARAB9AF2 | |
| SCHEMBL926155 | 0.96 | TSHR (0.47) | TSHRMAOBMAOARAB9AF2 | |
| SCHEMBL925116 | 0.96 | TSHR (0.47) | TSHRMAOBMAOARAB9AF2 | |
| SCHEMBL927464 | 0.96 | TSHR (0.47) | TSHRMAOBMAOARAB9AF2 | |
| SCHEMBL14662625 | 0.96 | TSHR (0.51) | TSHRMAOBMAOARAB9AF2 | |
| SCHEMBL5093977 | 0.90 | MAOB (0.45) | TSHRMAOBMAOARAB9AF2 | |
| SCHEMBL9763338 | 0.86 | TSHR (0.48) | TSHRMAOBMAOACYP1A2CYP2D6 | |
| SCHEMBL926393 | 0.84 | TSHR (0.51) | TSHRMAOBMAOARAB9AF2 | |
| SCHEMBL6255009 | 0.84 | TSHR (0.51) | TSHRMAOBMAOARAB9AF2 | |
| SCHEMBL6251727 | 0.84 | TSHR (0.59) | TSHRMAOBMAOAF2LMNA |
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-2012003418-A2 | FUNCTIONALLY SELECTIVE LIGANDS OF DOPAMINE D2 RECEPTORS | THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) | 2012-01-05 | — | — | WO | disclosed |