Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.48 |
| ▸ | KDR | P35968 | 9/20 | 0.46 |
| ▸ | FAAH | O00519 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 4/20 | 0.45 |
| ▸ | NPC1 | O15118 | 3/20 | 0.45 |
| ▸ | PKM | P14618 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | HTR1A | P08908 | 1/20 | 0.42 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL5724777 | 0.80 | LMNA (0.63) | ALDH1A1L3MBTL1KDRMAPK1RAB9A | |
| SCHEMBL28393945 | 0.76 | ALDH1A1 (0.43) | ALDH1A1L3MBTL1HPGDRAB9ASMN1; SMN2 | |
| SCHEMBL28182094 | 0.74 | DPP7 (0.42) | ALDH1A1L3MBTL1FAAHMAPK1HPGD | |
| SCHEMBL10009137 | 0.73 | NPC1 (0.59) | ALDH1A1HPGDRAB9ANPC1SMN1; SMN2 | |
| Pyridine SCHEMBL28843712 | 0.73 | ALDH1A1 (0.50) | ALDH1A1L3MBTL1MAPK1HPGDRAB9A | |
| SCHEMBL10009090 | 0.72 | SMN1; SMN2 (0.60) | ALDH1A1L3MBTL1MAPK1HPGDRAB9A | |
| SCHEMBL28393946 | 0.72 | ALDH1A1 (0.58) | ALDH1A1GAAMAPTCYP1A2CYP3A4 | |
| SCHEMBL1136767 | 0.72 | KDR (0.48) | KDRKCNH2LMNA | |
| SCHEMBL23366762 | 0.72 | L3MBTL1 (0.70) | ALDH1A1L3MBTL1MAPK1HPGDRAB9A | |
| SCHEMBL5879585 | 0.72 | KDR (0.60) | KDRRAB9ANPC1MEN1KMT2A |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106699752-B | Application of the 5- piperonyl -2- pridylamino thiazole as anticancer drug | 湖南大学 | 2019-05-14 | — | — | CN | claimed |
| CN-106699752-B | Application of the 5- piperonyl -2- pridylamino thiazole as anticancer drug | 湖南大学 | 2019-05-14 | — | — | CN | disclosed |
| CN-106699752-B | Application of the 5- piperonyl -2- pridylamino thiazole as anticancer drug | 湖南大学 | 2019-05-14 | — | — | CN | disclosed |
| CN-106699752-B | Application of the 5- piperonyl -2- pridylamino thiazole as anticancer drug | 湖南大学 | 2019-05-14 | — | — | CN | disclosed |