Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.34 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.34 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.34 |
| ▸ | ELANE | P08246 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.33 |
| ▸ | CFTR | P13569 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | CA12 | O43570 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL28701873 | 0.79 | MEN1 (0.37) | KMT2AMEN1ALDH1A1PTGS1KDM4E | |
| SCHEMBL31392645 | 0.79 | CA2 (0.41) | KMT2AMEN1CA12CA1CA2 | |
| SCHEMBL9695525 | 0.77 | ALDH1A1 (0.41) | KMT2AMEN1TSHRSMN1; SMN2ALDH1A1 | |
| SCHEMBL30613582 | 0.77 | ALDH1A1 (0.41) | KMT2AMEN1TSHRSMN1; SMN2ALDH1A1 | |
| SCHEMBL4079803 | 0.77 | TDP1 (0.44) | KMT2AMEN1TSHRALDH1A1TDP1 | |
| SCHEMBL13145649 | 0.76 | ALDH1A1 (0.56) | KMT2AMEN1TSHRSMN1; SMN2ALDH1A1 | |
| SCHEMBL28913034 | 0.75 | MEN1 (0.34) | KMT2AMEN1IRAK4 | |
| SCHEMBL142738 | 0.75 | SMN1; SMN2 (0.49) | KMT2AMEN1TSHRSMN1; SMN2ALDH1A1 | |
| SCHEMBL32677394 | 0.75 | SMN1; SMN2 (0.49) | KMT2AMEN1TSHRSMN1; SMN2ALDH1A1 | |
| SCHEMBL32677395 | 0.75 | SMN1; SMN2 (0.49) | KMT2AMEN1TSHRSMN1; SMN2ALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108137544-B | Aminopyrimidines useful for inhibiting protein tyrosine kinase activity | 深圳市塔吉瑞生物医药有限公司 | 2022-01-04 | — | — | CN | disclosed |
| CN-108137559-B | Pyrimidine derivatives as BTK inhibitors and uses thereof | 默克专利有限公司 | 2021-11-02 | — | — | CN | disclosed |
| EP-1944305-B1 | Quinoline derivatives as phosphodiesterase inhibitors | GLAXO GROUP LTD (GB) | 2011-10-19 | — | — | EP | disclosed |