Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 2/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.47 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | GABRP | O00591 | 1/20 | 0.47 |
| ▸ | GABRD | O14764 | 1/20 | 0.47 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.47 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.47 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.47 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.47 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.47 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.47 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.47 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.47 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.47 |
| ▸ | GABRE | P78334 | 1/20 | 0.47 |
| ▸ | GABRA6 | Q16445 | 1/20 | 0.47 |
| ▸ | GABRG1 | Q8N1C3 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL31532 | 0.87 | MAPK1 (0.65) | MAPK1KDM4EL3MBTL1HDAC1HDAC6 | |
| SCHEMBL29826707 | 0.87 | MAPK1 (0.65) | MAPK1KDM4EL3MBTL1HDAC1HDAC6 | |
| Hydrochloric Acid SCHEMBL2177614 | 0.86 | MAPK1 (0.62) | MAPK1KDM4EL3MBTL1HDAC1HDAC6 | |
| SCHEMBL7362601 | 0.77 | MAPK1 (0.51) | MAPK1KDM4EL3MBTL1HDAC1HDAC6 | |
| SCHEMBL5543060 | 0.75 | MKNK1 (0.65) | MAPK1KDM4EL3MBTL1HDAC1HDAC6 | |
| Methyl Nicotinate SCHEMBL28779676 | 0.75 | ALDH1A1 (0.76) | L3MBTL1SMN1; SMN2KMT2AALDH1A1HPGD | |
| SCHEMBL2643803 | 0.74 | NNMT (0.56) | MAPK1KDM4EL3MBTL1HDAC1HDAC6 | |
| SCHEMBL2734773 | 0.73 | CDK8 (0.53) | MAPK1KDM4EHDAC1HDAC6SMN1; SMN2 | |
| Methyl Benzoate SCHEMBL28942733 | 0.73 | TSHR (0.70) | L3MBTL1SMN1; SMN2KMT2ANPC1RAB9A | |
| SCHEMBL64370 | 0.72 | NPC1 (0.71) | KDM4ESMN1; SMN2KMT2ANPC1RAB9A |
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-105153119-B | Pyridine pyrimidinamine compound or pyridine pyridyl amine compound and its application | 广州必贝特医药技术有限公司 | 2019-01-01 | — | — | CN | disclosed |
| CN-105153119-A | Pyridylpyrimidyl amine compounds or pyridylpyridyl amine compounds and application thereof | GUANGZHOU KEQIN NEW MEDICINE DESIGN CO LTD | 2015-12-16 | — | — | CN | disclosed |