Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | HPGD | P15428 | 3/20 | 0.48 |
| ▸ | GAA | P10253 | 2/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | CASP1 | P29466 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | LCK | P06239 | 1/20 | 0.38 |
| ▸ | METAP1 | P53582 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 3/20 | 0.38 |
| ▸ | TNF | P01375 | 2/20 | 0.37 |
| ▸ | AKR1C2 | P52895 | 2/20 | 0.37 |
| ▸ | ESR1 | P03372 | 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 | |
|---|---|---|---|---|
| SCHEMBL9922254 | 0.81 | ALDH1A1 (0.63) | KDM4EALDH1A1HPGDGAACYP1A2 | |
| SCHEMBL1399960 | 0.79 | HSD17B10 (0.63) | KDM4EALDH1A1SMN1; SMN2HSD17B10LCK | |
| SCHEMBL9922257 | 0.73 | METAP1 (0.55) | KDM4EALDH1A1HPGDGAACYP1A2 | |
| SCHEMBL11774872 | 0.69 | SMN1; SMN2 (0.53) | KDM4EALDH1A1HPGDCYP3A4L3MBTL1 | |
| SCHEMBL7314126 | 0.69 | HSD17B10 (0.61) | KDM4EALDH1A1HPGDGAACYP3A4 | |
| SCHEMBL6882571 | 0.68 | POLB (0.69) | KDM4EALDH1A1HPGDGAACYP1A2 | |
| SCHEMBL744543 | 0.68 | HSD17B10 (0.68) | KDM4ESMN1; SMN2HSD17B10LCKPOLB | |
| SCHEMBL13469239 | 0.67 | SMN1; SMN2 (0.57) | KDM4EALDH1A1HPGDGAAL3MBTL1 | |
| SCHEMBL26679226 | 0.67 | POLB (0.59) | KDM4EALDH1A1HPGDCYP1A2CYP3A4 | |
| SCHEMBL13495344 | 0.67 | ALDH1A1 (0.62) | KDM4EALDH1A1HPGDGAACYP1A2 |
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-3901149-A1 | IMPURITIES OF AMIDE DERIVATIVES AND USE THEREOF | NHWA Pharma Corporation (CN) | 2021-10-27 | — | — | EP | disclosed |