Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SOS1 | Q07889 | 4/20 | 0.59 |
| ▸ | KDM4E | B2RXH2 | 11/20 | 0.54 |
| ▸ | MAPT | P10636 | 10/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 9/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.54 |
| ▸ | MEN1 | O00255 | 6/20 | 0.54 |
| ▸ | HTT | P42858 | 5/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.54 |
| ▸ | POLB | P06746 | 2/20 | 0.54 |
| ▸ | TSHR | P16473 | 4/20 | 0.52 |
| ▸ | USP2 | O75604 | 2/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 6/20 | 0.49 |
| ▸ | LMNA | P02545 | 5/20 | 0.49 |
| ▸ | HPGD | P15428 | 4/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.49 |
| ▸ | GAA | P10253 | 2/20 | 0.49 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.48 |
| ▸ | CASP1 | P29466 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL29558247 | 0.86 | KDM4E (0.66) | SOS1KDM4EMAPTKMT2AALDH1A1 | |
| SCHEMBL3061852 | 0.86 | MAPT (0.68) | SOS1KDM4EMAPTKMT2AALDH1A1 | |
| SCHEMBL29490094 | 0.83 | SOS1 (0.83) | SOS1KDM4EMAPTKMT2AALDH1A1 | |
| SCHEMBL22342966 | 0.83 | SOS1 (0.83) | SOS1KDM4EMAPTKMT2AALDH1A1 | |
| SCHEMBL29558358 | 0.81 | NPY5R (0.49) | MAPTKMT2AALDH1A1MEN1HTT | |
| SCHEMBL29558644 | 0.80 | KDM4E (0.55) | SOS1KDM4EMAPTKMT2AALDH1A1 | |
| SCHEMBL29558270 | 0.79 | APP (0.48) | KDM4EMAPTKMT2AMEN1HTT | |
| SCHEMBL29558895 | 0.78 | KDM4E (0.60) | SOS1KDM4EMAPTKMT2AALDH1A1 | |
| SCHEMBL28725385 | 0.78 | KDM4E (0.60) | SOS1KDM4EMAPTKMT2AALDH1A1 | |
| SCHEMBL29559170 | 0.75 | ABCG2 (0.44) | SOS1MAPTKMT2AMEN1POLB |
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-114380753-A | Aryl or heteroaryl substituted quinoxaline-2, 3-diamine compound and antibacterial application thereof | 中国医学科学院药物研究所 | 2022-04-22 | — | — | CN | claimed |
| CN-114380753-A | Aryl or heteroaryl substituted quinoxaline-2, 3-diamine compound and antibacterial application thereof | 中国医学科学院药物研究所 | 2022-04-22 | — | — | CN | disclosed |