Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 12/20 | 0.49 |
| ▸ | MEN1 | O00255 | 3/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | THRB | P10828 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | FABP4 | P15090 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | CNR1 | P21554 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL12479862 | 0.87 | ALDH1A1 (0.48) | KMT2AMEN1KDM4EALDH1A1THRB | |
| SCHEMBL27387445 | 0.87 | KMT2A (0.48) | KMT2AMEN1KDM4EALDH1A1THRB | |
| SCHEMBL30394690 | 0.86 | CREBBP (0.58) | KMT2AMEN1KDM4EALDH1A1THRB | |
| SCHEMBL8359818 | 0.86 | KMT2A (0.60) | KMT2AMEN1KDM4EALDH1A1THRB | |
| SCHEMBL25428769 | 0.83 | LMNA (0.50) | KMT2AMEN1KDM4EALDH1A1THRB | |
| SCHEMBL4205321 | 0.82 | KMT2A (0.47) | KMT2AMEN1KDM4EALDH1A1THRB | |
| SCHEMBL10596904 | 0.81 | KDM4E (0.50) | KMT2AMEN1KDM4EALDH1A1LMNA | |
| SCHEMBL19668173 | 0.80 | LMNA (0.56) | KMT2AMEN1KDM4EALDH1A1LMNA | |
| SCHEMBL12481379 | 0.79 | KDM4E (0.41) | KMT2AMEN1KDM4EALDH1A1THRB | |
| SCHEMBL8530588 | 0.79 | KDM4E (0.41) | KMT2AMEN1KDM4EALDH1A1THRB |
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-111303148-B | 1-substituted beta-carboline derivatives and application thereof | 南京农业大学 | 2022-08-30 | — | — | CN | disclosed |
| WO-2020037116-A1 | SMALL MOLECULE PYRIN-DOMAIN TARGETED NLRP3 INFLAMMASOME INHIBITORS | H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. (US) | 2020-02-20 | — | — | WO | disclosed |