Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 2/20 | 0.34 |
| ▸ | MGAM | O43451 | 1/20 | 0.34 |
| ▸ | SI | P14410 | 1/20 | 0.34 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 3/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9533341 | 0.76 | GAA (0.41) | GAAMGAMSIMGAM2ALDH1A1 | |
| SCHEMBL7283280 | 0.73 | KMT2A (0.46) | KDM4EHPGD | |
| SCHEMBL11547161 | 0.72 | MGAM (0.44) | GAAMGAMSIMGAM2ALDH1A1 | |
| SCHEMBL27351821 | 0.72 | MGAM (0.50) | GAAMGAMSIMGAM2ALDH1A1 | |
| SCHEMBL5902428 | 0.71 | SIGMAR1 (0.46) | ALDH1A1KDM4E | |
| SCHEMBL28166355 | 0.71 | MGAM (0.36) | GAAMGAMSIMGAM2ALDH1A1 | |
| SCHEMBL7236982 | 0.71 | KDM4E (0.49) | ALDH1A1KDM4EMAPTPOLB | |
| SCHEMBL27965527 | 0.71 | MGAM (0.36) | GAAMGAMSIMGAM2ALDH1A1 | |
| SCHEMBL27657768 | 0.71 | MGAM (0.43) | GAAMGAMSIMGAM2 | |
| SCHEMBL27984239 | 0.71 | MGAM (0.43) | GAAMGAMSIMGAM2TDP1 |
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-106458930-B | 2-aminopyrimidine compound and pharmaceutical composition and application thereof | 中国科学院上海药物研究所 | 2019-10-11 | — | — | CN | disclosed |
| CN-106458930-A | 2-aminopyrimidine compound and pharmaceutical composition and application thereof | 中国科学院上海药物研究所 | 2017-02-22 | — | — | CN | disclosed |
| CN-105601573-A | 2-aminopyrimidine compounds as well as pharmaceutical compositions and applications thereof | SHANGHAI INST MATERIA MEDICA CAS | 2016-05-25 | — | — | CN | disclosed |