Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MLYCD | O95822 | 1/20 | 0.65 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.52 |
| ▸ | MAPT | P10636 | 4/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.52 |
| ▸ | GAA | P10253 | 4/20 | 0.52 |
| ▸ | HTT | P42858 | 2/20 | 0.52 |
| ▸ | THRB | P10828 | 2/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.52 |
| ▸ | RECQL | P46063 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.51 |
| ▸ | NPC1 | O15118 | 4/20 | 0.50 |
| ▸ | RAB9A | P51151 | 4/20 | 0.50 |
| ▸ | ESR1 | P03372 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL5935115 | 0.86 | MLYCD (0.67) | MLYCDKDM4EMAPTALDH1A1HTT | |
| Water SCHEMBL11233238 | 0.85 | MLYCD (0.62) | MLYCDKDM4EMAPTALDH1A1GAA | |
| Water SCHEMBL11233247 | 0.85 | MLYCD (0.62) | MLYCDKDM4EMAPTALDH1A1GAA | |
| SCHEMBL22983342 | 0.82 | ALDH1A1 (0.65) | MLYCDKDM4EMAPTALDH1A1GAA | |
| SCHEMBL11233224 | 0.78 | MLYCD (0.55) | MLYCDKDM4EMAPTALDH1A1GAA | |
| SCHEMBL31699264 | 0.78 | ALDH1A1 (0.59) | MLYCDKDM4EMAPTALDH1A1GAA | |
| SCHEMBL161322 | 0.78 | ALDH1A1 (0.59) | MLYCDKDM4EMAPTALDH1A1GAA | |
| SCHEMBL6237453 | 0.78 | KDM4E (0.68) | MLYCDKDM4EALDH1A1GAAHTT | |
| SCHEMBL14426585 | 0.77 | MLYCD (0.54) | MLYCDKDM4EALDH1A1GAAHTT | |
| SCHEMBL6802143 | 0.77 | HSP90AA1 (0.60) | MLYCDKDM4EMAPTALDH1A1HTT |
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 |
|---|---|---|---|---|---|---|---|
| CN-109134336-B | Diaryl ether compound, preparation method and application thereof | 北京大学深圳研究生院 | 2021-08-03 | — | — | CN | disclosed |