Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR2 | P34972 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.45 |
| ▸ | MEN1 | O00255 | 4/20 | 0.45 |
| ▸ | MAPT | P10636 | 3/20 | 0.45 |
| ▸ | CRHBP | P24387 | 1/20 | 0.45 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 4/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.43 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 5/20 | 0.42 |
| ▸ | RAB9A | P51151 | 5/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | KCNJ1 | P48048 | 1/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 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 | |
|---|---|---|---|---|
| SCHEMBL28844860 | 0.79 | KMT2A (0.49) | CNR2KMT2AMEN1MAPTCRHBP | |
| SCHEMBL29532060 | 0.77 | APP (0.50) | NPSR1ALDH1A1CYP2D6ATM | |
| SCHEMBL509565 | 0.77 | APP (0.50) | NPSR1ALDH1A1CYP2D6ATM | |
| SCHEMBL28360853 | 0.74 | ALDH1A1 (0.47) | NPSR1ALDH1A1LMNACYP2D6ATM | |
| SCHEMBL11365490 | 0.74 | ALDH1A1 (0.47) | NPSR1ALDH1A1CYP2D6ATM | |
| SCHEMBL14880488 | 0.73 | KCNJ1 (0.63) | KMT2AMEN1MAPTCRHBPCRHR2 | |
| SCHEMBL28149996 | 0.72 | KMT2A (0.56) | CNR2KMT2AMEN1MAPTCRHBP | |
| SCHEMBL31473910 | 0.72 | ALDH1A1 (0.47) | NPSR1ALDH1A1CYP2D6ATM | |
| SCHEMBL11368763 | 0.72 | ALDH1A1 (0.47) | NPSR1ALDH1A1CYP2D6ATM | |
| SCHEMBL28148862 | 0.71 | ACHE (0.45) | KMT2AMAPTHTTGAAALDH1A1 |
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-105017152-B | Preparation method of 3-chloro-6-nitroisoquinoline or 3-bromine-6-nitroisoquinoline | 北京六合宁远科技有限公司 | 2017-05-10 | — | — | CN | claimed |
| CN-105017152-B | Preparation method of 3-chloro-6-nitroisoquinoline or 3-bromine-6-nitroisoquinoline | 北京六合宁远科技有限公司 | 2017-05-10 | — | — | CN | disclosed |
| CN-105017152-A | Preparation method of 3-chloro(bromo)-6-nitroisoquinoline | BEIJING LIUHE NINGYUAN TECHNOLOGY CO LTD | 2015-11-04 | — | — | CN | disclosed |