Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.56 |
| ▸ | POLB | P06746 | 2/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.56 |
| ▸ | HPGD | P15428 | 2/20 | 0.56 |
| ▸ | RAB9A | P51151 | 2/20 | 0.56 |
| ▸ | NPC1 | O15118 | 1/20 | 0.56 |
| ▸ | LMNA | P02545 | 1/20 | 0.56 |
| ▸ | GLA | P06280 | 1/20 | 0.56 |
| ▸ | GAA | P10253 | 1/20 | 0.56 |
| ▸ | PTBP1 | P26599 | 1/20 | 0.56 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.56 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.55 |
| ▸ | MEN1 | O00255 | 1/20 | 0.55 |
| ▸ | TDP2 | O95551 | 1/20 | 0.55 |
| ▸ | NSD2 | O96028 | 1/20 | 0.55 |
| ▸ | MAPT | P10636 | 1/20 | 0.55 |
| ▸ | BLM | P54132 | 1/20 | 0.55 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL3826117 | 0.85 | NCF1 (0.56) | ALDH1A1KDM4EPOLBKMT2AHPGD | |
| SCHEMBL862361 | 0.82 | PDE3B (0.49) | ALDH1A1HPGDHSD17B10CYP1A2NUDT1 | |
| SCHEMBL19700637 | 0.77 | GPR3 (0.44) | ALDH1A1KDM4EHPGDGAAHSD17B10 | |
| SCHEMBL7516105 | 0.77 | ALDH1A1 (0.48) | ALDH1A1KDM4EKMT2AHPGDRAB9A | |
| SCHEMBL29923623 | 0.77 | BACE1 (0.47) | ALDH1A1KDM4EKMT2AHPGDLMNA | |
| SCHEMBL24916325 | 0.77 | BACE1 (0.47) | ALDH1A1KDM4EKMT2AHPGDLMNA | |
| SCHEMBL17942715 | 0.77 | PDE3B (0.49) | ALDH1A1KDM4EPOLBKMT2AHPGD | |
| SCHEMBL24915591 | 0.74 | DHFR (0.48) | ALDH1A1HPGDLMNAHSD17B10BLM | |
| SCHEMBL28492152 | 0.74 | KDM4E (0.47) | ALDH1A1KDM4EHPGDGAARCE1 | |
| SCHEMBL28961997 | 0.73 | BACE1 (0.47) | ALDH1A1KMT2AHPGDHSD17B10CYP1A2 |
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-107382969-B | Phenylpyrazole zwitterionic compound and application thereof in resistant pest control | 华南农业大学 | 2020-08-07 | — | — | CN | disclosed |
| CN-107382969-A | Phenyl pyrazoles zwitterionic compound and its application in resistant insect preventing and treating | 华南农业大学 | 2017-11-24 | — | — | CN | disclosed |
| CN-104356006-B | Benzylamine, their preparation method and they as anti-inflammatory agent purposes | 拜耳知识产权有限责任公司 | 2017-09-29 | — | — | CN | disclosed |
| CN-105136787-A | Detection reagent for mono-hydroxyphenyl metabolin urine | SHANGHAI FEI JI BIOTECHNOLOGY CO LTD | 2015-12-09 | — | — | CN | disclosed |