Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.62 |
| ▸ | MAPT | P10636 | 3/20 | 0.54 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.54 |
| ▸ | HTT | P42858 | 2/20 | 0.54 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.54 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.54 |
| ▸ | HPGD | P15428 | 1/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.54 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.49 |
| ▸ | MEN1 | O00255 | 3/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.49 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.49 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL28576991 | 1.00 | KDM4E (0.62) | KDM4EMAPTHSP90AA1HTTNPSR1 | |
| SCHEMBL22800160 | 0.99 | KDM4E (0.64) | KDM4EMAPTHSP90AA1HTTNPSR1 | |
| SCHEMBL22800165 | 0.94 | KDM4E (0.65) | KDM4EMAPTHSP90AA1HTTNPSR1 | |
| SCHEMBL28576934 | 0.90 | KDM4E (0.68) | KDM4EMAPTHSP90AA1HTTNPSR1 | |
| SCHEMBL28579092 | 0.84 | KDM4E (0.60) | KDM4EMAPTHTTNPSR1ALDH1A1 | |
| SCHEMBL28582600 | 0.84 | KDM4E (0.60) | KDM4EMAPTHTTNPSR1ALDH1A1 | |
| SCHEMBL31265187 | 0.84 | KDM4E (0.60) | KDM4EMAPTHTTNPSR1ALDH1A1 | |
| SCHEMBL22799642 | 0.82 | KDM4E (0.61) | KDM4EMAPTHTTNPSR1ALDH1A1 | |
| SCHEMBL22324528 | 0.82 | LMNA (0.70) | KDM4EMAPTHSP90AA1HTTNPSR1 | |
| SCHEMBL7954710 | 0.82 | LMNA (0.70) | KDM4EMAPTHSP90AA1HTTNPSR1 |
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-108191957-B | Tripeptide macrocyclic derivatives, preparation method and application thereof | 浙江大学 | 2021-05-04 | — | — | CN | disclosed |