Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3R2 | O00459 | 1/20 | 0.51 |
| ▸ | GRM5 | P41594 | 3/20 | 0.49 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.47 |
| ▸ | HTR2A | P28223 | 3/20 | 0.46 |
| ▸ | HTR2C | P28335 | 3/20 | 0.46 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | USP2 | O75604 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | ESR1 | P03372 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL18355726 | 0.83 | HTR2A (0.49) | PIK3R2GRM5NOTUMGAAMDM2 | |
| SCHEMBL16063426 | 0.83 | CNR1 (0.54) | GRM5PKMHPGDLMNATSHR | |
| SCHEMBL18355722 | 0.82 | ALDH1A1 (0.60) | GRM5HTR2AHTR2CSLC6A4HPGD | |
| SCHEMBL1077551 | 0.75 | HTR2A (0.47) | PIK3R2NOTUMGAAHTR2AHTR2C | |
| SCHEMBL9826870 | 0.74 | GAA (0.51) | NOTUMGAAHTR2APKMHPGD | |
| SCHEMBL1080644 | 0.73 | HTR2A (0.49) | HTR2AHTR2CSLC6A4CYP2D6CYP2C9 | |
| SCHEMBL28800131 | 0.72 | PKM (0.54) | NOTUMGAAMDM2CYP1A2CYP2D6 | |
| SCHEMBL29800353 | 0.72 | PKM (0.54) | NOTUMGAAMDM2CYP1A2CYP2D6 | |
| SCHEMBL1077899 | 0.72 | GRM5 (0.59) | GRM5GAAHTR2AHTR2CSLC6A4 | |
| SCHEMBL18355607 | 0.72 | ATM (0.46) | GRM5NOTUMGAAHTR2AHTR2C |
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-2011005052-A2 | NOVEL ARYLPIPERAZINE-CONTAINING IMIDAZOLE 4-CARBOXAMIDE DERIVATIVES AND PHARMACEUTICAL COMPOSITION COMPRISING SAME | GREEN GROSS CORPORATION (KR) | 2011-01-13 | — | — | WO | disclosed |