Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR3C2 | P08235 | 8/20 | 0.44 |
| ▸ | NR3C1 | P04150 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | MDM2 | Q00987 | 5/20 | 0.41 |
| ▸ | MDM4 | O15151 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL1804668 | 0.78 | TSHR (0.52) | CYP1A2CYP2D6TSHRCYP2C19ALDH1A1 | |
| SCHEMBL18555858 | 0.71 | NR4A2 (0.51) | CYP1A2CYP2D6TSHRCYP2C19ALDH1A1 | |
| SCHEMBL164411 | 0.71 | HPGD (0.53) | ALDH1A1HPGDSLC6A4SLC6A3SMN1; SMN2 | |
| SCHEMBL14012583 | 0.71 | HPGD (0.53) | ALDH1A1HPGDSLC6A4SLC6A3SMN1; SMN2 | |
| SCHEMBL21693615 | 0.71 | KDM4E (0.46) | CYP1A2CYP2D6TSHRCYP2C19ALDH1A1 | |
| SCHEMBL29381749 | 0.71 | KDM4E (0.46) | CYP1A2CYP2D6TSHRCYP2C19ALDH1A1 | |
| SCHEMBL1803598 | 0.70 | KDM4E (0.68) | CYP1A2CYP2D6TSHRCYP2C19ALDH1A1 | |
| SCHEMBL23478014 | 0.69 | TSHR (0.44) | CYP1A2CYP2D6TSHRCYP2C19ALDH1A1 | |
| SCHEMBL1401560 | 0.69 | TSHR (0.57) | CYP1A2CYP2D6TSHRCYP2C19ALDH1A1 | |
| SCHEMBL1802753 | 0.69 | NR3C2 (0.40) | NR3C2CYP1A2CYP2D6TSHRCYP2C19 |
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-2322502-B1 | METHOD FOR PRODUCING AMIDE DERIVATIVE | MITSUI CHEMICALS AGRO INC (JP) | 2019-09-18 | — | — | EP | disclosed |