Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 3/20 | 0.45 |
| ▸ | CTSB | P07858 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | ERN1 | O75460 | 2/20 | 0.41 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | GSK3B | P49841 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | CASP6 | P55212 | 1/20 | 0.37 |
| ▸ | PARP1 | P09874 | 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 | |
|---|---|---|---|---|
| SCHEMBL25298464 | 1.00 | ALDH1A1 (0.51) | ALDH1A1CYP3A4KMT2AHTTLMNA | |
| SCHEMBL4632242 | 0.90 | KMT2A (0.53) | ALDH1A1CYP3A4KMT2AHTTLMNA | |
| SCHEMBL4633313 | 0.86 | KMT2A (0.49) | ALDH1A1KMT2AHTTLMNAMEN1 | |
| SCHEMBL29447926 | 0.84 | KMT2A (0.47) | ALDH1A1KMT2AHTTLMNAMEN1 | |
| SCHEMBL25253595 | 0.84 | KMT2A (0.47) | ALDH1A1KMT2AHTTLMNAMEN1 | |
| SCHEMBL452336 | 0.80 | ALDH1A1 (0.58) | ALDH1A1CYP3A4LMNACTSBHCAR3 | |
| SCHEMBL21544194 | 0.79 | ALDH1A1 (0.52) | ALDH1A1KMT2AHTTLMNAMEN1 | |
| SCHEMBL29809179 | 0.79 | MAPT (0.44) | ALDH1A1KMT2AHTTLMNAMEN1 | |
| SCHEMBL25250002 | 0.79 | MAPT (0.44) | ALDH1A1KMT2AHTTLMNAMEN1 | |
| SCHEMBL443612 | 0.78 | ALDH1A1 (0.51) | ALDH1A1CYP3A4KMT2ACTSBMEN1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114805317-A | Preparation method of Tegolrazan | 江苏威奇达药业有限公司 | 2022-07-29 | — | — | CN | claimed |
| CN-114805317-A | Preparation method of Tegolrazan | 江苏威奇达药业有限公司 | 2022-07-29 | — | — | CN | disclosed |