Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 3/20 | 0.40 |
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| 2-Nitroaniline SCHEMBL27582191 | 0.81 | PDE7A (0.44) | ALDH1A1MAPK1HTTMEN1KMT2A | |
| Hydrochloric Acid SCHEMBL28308358 | 0.79 | HPGD (0.58) | ALDH1A1MAPK1HPGDKDM4EMEN1 | |
| SCHEMBL78743 | 0.79 | HPGD (0.62) | ALDH1A1MAPK1LMNAHTTHPGD | |
| SCHEMBL27873887 | 0.79 | HPGD (0.62) | ALDH1A1MAPK1LMNAHTTHPGD | |
| SCHEMBL29962795 | 0.79 | HPGD (0.62) | ALDH1A1MAPK1LMNAHTTHPGD | |
| Selenium SCHEMBL10603347 | 0.77 | HPGD (0.60) | ALDH1A1MAPK1LMNAHTTHPGD | |
| SCHEMBL14855732 | 0.77 | HPGD (0.60) | ALDH1A1MAPK1LMNAHTTHPGD | |
| 1,2-Dichlorobenzene SCHEMBL11313909 | 0.77 | HPGD (0.60) | ALDH1A1MAPK1LMNAHTTHPGD | |
| Fluoride SCHEMBL3957036 | 0.77 | HPGD (0.60) | ALDH1A1MAPK1LMNAHTTHPGD | |
| Hydrochloric Acid SCHEMBL28518250 | 0.77 | HPGD (0.60) | ALDH1A1MAPK1LMNAHTTHPGD |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108424764-A | It is a kind of19F NMR probes and its preparation method and application | 南方医科大学 | 2018-08-21 | — | — | CN | claimed |
| CN-108997394-A | Benzoxaborole Polymorphs alkyl compound and preparation method thereof | 广州百霆医药科技有限公司 | 2018-12-14 | — | — | CN | disclosed |
| CN-108424764-A | It is a kind of19F NMR probes and its preparation method and application | 南方医科大学 | 2018-08-21 | — | — | CN | disclosed |
| CN-103796999-B | Luminescent substrates for luciferase enzymes | UNIV ELECTRO COMMUNICATIONS | 2015-07-22 | — | — | CN | disclosed |
| CN-103796999-A | Luminescent substrates for luciferase enzymes | UNIV ELECTRO COMMUNICATIONS | 2014-05-14 | — | — | CN | disclosed |
| CN-1082952-C | Pyrrolylpiperazinylphenyl oxazolidinone antimicrobials | UPJOHN CO (US) | 2002-04-17 | — | — | CN | disclosed |