Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | GCK | P35557 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | CFTR | P13569 | 2/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | GSTO1 | P78417 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL20535745 | 0.85 | MEN1 (0.36) | MEN1KMT2ALMNAGSTO1 | |
| SCHEMBL18758332 | 0.81 | BCHE (0.34) | MEN1KMT2AGCKKCNH2SMN1; SMN2 | |
| SCHEMBL28370917 | 0.80 | GCK (0.33) | GCKKCNH2 | |
| SCHEMBL20387999 | 0.79 | MEN1 (0.40) | MEN1KMT2ALMNACFTRSMN1; SMN2 | |
| SCHEMBL20388000 | 0.77 | MEN1 (0.36) | MEN1KMT2ALMNAGSTO1 | |
| SCHEMBL18758339 | 0.76 | MEN1 (0.39) | MEN1KMT2AKCNH2LMNACFTR | |
| SCHEMBL1133371 | 0.76 | SMN1; SMN2 (0.46) | MEN1KMT2AGCKKCNH2LMNA | |
| SCHEMBL2035163 | 0.74 | HDAC1 (0.33) | GCKMAPTHTT | |
| SCHEMBL17674555 | 0.74 | MEN1 (0.37) | MEN1KMT2ALMNACFTRGSTO1 | |
| SCHEMBL17674557 | 0.73 | MEN1 (0.35) | MEN1KMT2ALMNAGSTO1 |
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-110944664-A | Aziridines containing epothilone analogs, methods of synthesis, methods of treatment, and drug conjugates | 威廉马歇莱思大学 | 2020-03-31 | — | — | CN | disclosed |
| WO-2017066606-A1 | EPOTHILONE ANALOGS, METHODS OF SYNTHESIS, METHODS OF TREATMENT, AND DRUG CONJUGATES THEREOF | WILLIAM MARSH RICE UNIVERSITY (US) | 2017-04-20 | — | — | WO | disclosed |