Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | TSHR | P16473 | 3/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | TAS1R3 | Q7RTX0 | 2/20 | 0.43 |
| ▸ | TAS1R1 | Q7RTX1 | 2/20 | 0.43 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.43 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.42 |
| ▸ | DGAT2 | Q96PD7 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL2857544 | 0.90 | TSHR (0.45) | EPHX2ALDH1A1TSHRNPSR1TAS1R3 | |
| SCHEMBL2852937 | 0.87 | KLKB1 (0.43) | EPHX2ALDH1A1TSHRNPSR1TAS1R3 | |
| SCHEMBL2856282 | 0.87 | DGAT2 (0.54) | EPHX2ALDH1A1TSHRNPSR1TAS1R3 | |
| SCHEMBL2853809 | 0.83 | P2RX7 (0.49) | EPHX2ALDH1A1TSHRNPSR1TAS1R3 | |
| SCHEMBL2853175 | 0.82 | KLKB1 (0.43) | ALDH1A1TSHRNPSR1TAS1R3TAS1R1 | |
| SCHEMBL2857895 | 0.80 | GRM4 (0.48) | ALDH1A1KMT2AMEN1USP2MAPT | |
| SCHEMBL2857366 | 0.79 | CCR1 (0.47) | — | |
| SCHEMBL2857357 | 0.78 | HTT (0.46) | NPSR1KMT2AMEN1CYP1A2CYP3A4 | |
| SCHEMBL2856479 | 0.78 | MAPK1 (0.41) | ALDH1A1KMT2AMEN1HPGD | |
| SCHEMBL2852370 | 0.77 | ALDH1A1 (0.52) | ALDH1A1TSHRKMT2ACYP1A2CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1451160-B1 | PYRAZOLE-AMIDES FOR USE IN THE TREATMENT OF PAIN | ICAGEN INC (US) | 2010-01-13 | — | — | EP | claimed |