Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.63 |
| ▸ | GAA | P10253 | 2/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.58 |
| ▸ | POLB | P06746 | 2/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.54 |
| ▸ | HTT | P42858 | 1/20 | 0.54 |
| ▸ | MAPK10 | P53779 | 2/20 | 0.52 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.52 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | RBP4 | P02753 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL27546648 | 0.86 | GAA (0.65) | GAAKMT2APOLBALDH1A1LMNA | |
| SCHEMBL8691586 | 0.82 | ALDH1A1 (0.70) | KDM4EGAAKMT2APOLBALDH1A1 | |
| SCHEMBL22497429 | 0.81 | KDM4E (0.74) | KDM4EGAAKMT2APOLBALDH1A1 | |
| SCHEMBL16127720 | 0.80 | GAA (0.62) | KDM4EGAAKMT2APOLBALDH1A1 | |
| SCHEMBL7108471 | 0.78 | KDM4E (1.00) | KDM4EGAAKMT2APOLBALDH1A1 | |
| SCHEMBL4797746 | 0.77 | KMT2A (0.73) | KDM4EGAAKMT2APOLBALDH1A1 | |
| SCHEMBL21015416 | 0.76 | EPHX2 (0.51) | KDM4EGAAPOLBALDH1A1HTT | |
| SCHEMBL28057817 | 0.76 | GAA (0.52) | GAAKMT2APOLBALDH1A1MEN1 | |
| SCHEMBL27519885 | 0.75 | GRIK1 (0.55) | KDM4EGAAKMT2APOLBHSD17B10 | |
| SCHEMBL28373311 | 0.75 | KDM4E (0.59) | KDM4EKMT2APOLBALDH1A1HTT |
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-111763164-A | Preparation method and application of ortho-carbonyl amino substituted benzene derivatives | 中国医学科学院药物研究所 | 2020-10-13 | — | — | CN | disclosed |
| WO-2020199945-A1 | ORTHO-CARBONYL AMINO-SUBSTITUTED BENZENE DERIVATIVE, AND PREPARATION METHOD THEREFOR AND USE THEREOF | 中国医学科学院药物研究所 | 2020-10-08 | — | — | WO | disclosed |