Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.52 |
| ▸ | GABRP | O00591 | 2/20 | 0.52 |
| ▸ | GABRD | O14764 | 2/20 | 0.52 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.52 |
| ▸ | GABRB1 | P18505 | 2/20 | 0.52 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.52 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.52 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.52 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.52 |
| ▸ | GABRA2 | P47869 | 2/20 | 0.52 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.52 |
| ▸ | GABRA4 | P48169 | 2/20 | 0.52 |
| ▸ | GABRE | P78334 | 2/20 | 0.52 |
| ▸ | GABRA6 | Q16445 | 2/20 | 0.52 |
| ▸ | GABRG1 | Q8N1C3 | 2/20 | 0.52 |
| ▸ | GABRG3 | Q99928 | 2/20 | 0.52 |
| ▸ | GABRQ | Q9UN88 | 2/20 | 0.52 |
| ▸ | MEN1 | O00255 | 3/20 | 0.52 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.51 |
| ▸ | STAT3 | P40763 | 4/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL29424954 | 1.00 | KMT2A (0.52) | KMT2AGABRPGABRDGABRA1GABRB1 | |
| SCHEMBL28429347 | 0.92 | STAT3 (0.52) | KMT2AGABRPGABRDGABRA1GABRB1 | |
| SCHEMBL29817685 | 0.90 | KMT2A (0.56) | KMT2AGABRPGABRDGABRA1GABRB1 | |
| SCHEMBL27168680 | 0.90 | KMT2A (0.56) | KMT2AGABRPGABRDGABRA1GABRB1 | |
| SCHEMBL29034855 | 0.89 | DYRK1A (0.55) | KMT2AGABRPGABRDGABRA1GABRB1 | |
| SCHEMBL26943206 | 0.86 | STAT3 (0.63) | KMT2AGABRPGABRDGABRA1GABRB1 | |
| SCHEMBL28929841 | 0.85 | STAT3 (0.53) | KMT2AGABRPGABRDGABRA1GABRB1 | |
| SCHEMBL29424962 | 0.85 | MEN1 (0.57) | KMT2AMEN1STAT3LMNAKDM4E | |
| SCHEMBL29425002 | 0.84 | STAT3 (0.49) | KMT2AGABRPGABRDGABRA1GABRB1 | |
| SCHEMBL21724980 | 0.84 | MAPT (0.71) | KMT2AGABRPGABRDGABRA1GABRB1 |
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 4 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 |
| CN-111303148-A | 1-substituted β -carboline derivatives and application thereof | 南京农业大学 | 2020-06-19 | — | — | 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 |
| 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 |