Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.54 |
| ▸ | TSHR | P16473 | 3/20 | 0.54 |
| ▸ | LMNA | P02545 | 3/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.54 |
| ▸ | NPC1 | O15118 | 2/20 | 0.54 |
| ▸ | HPGD | P15428 | 2/20 | 0.54 |
| ▸ | RAB9A | P51151 | 2/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.54 |
| ▸ | MAPT | P10636 | 1/20 | 0.54 |
| ▸ | HTT | P42858 | 1/20 | 0.54 |
| ▸ | CDK5 | Q00535 | 2/20 | 0.50 |
| ▸ | CDK5R1 | Q15078 | 2/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 7/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.49 |
| ▸ | USP2 | O75604 | 6/20 | 0.49 |
| ▸ | MEN1 | O00255 | 5/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.49 |
| ▸ | CASP1 | P29466 | 4/20 | 0.49 |
| ▸ | CASP7 | P55210 | 4/20 | 0.49 |
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 | |
|---|---|---|---|---|
| Isocryptolepine SCHEMBL9390637 | 1.00 | ALDH1A1 (0.54) | ALDH1A1TSHRLMNAKDM4ENPC1 | |
| SCHEMBL7817360 | 0.79 | CYP3A4 (0.62) | ALDH1A1TSHRLMNAKDM4ENPC1 | |
| SCHEMBL21660484 | 0.78 | KDM4E (0.55) | TSHRKDM4EHPGDHTTCYP1A2 | |
| SCHEMBL7815125 | 0.75 | RAB9A (0.67) | ALDH1A1TSHRLMNAKDM4ENPC1 | |
| SCHEMBL21660696 | 0.74 | KDM4E (0.42) | ALDH1A1LMNAKDM4EHPGDHSD17B10 | |
| SCHEMBL17179429 | 0.72 | NPC1 (0.54) | ALDH1A1TSHRLMNAKDM4ENPC1 | |
| SCHEMBL21660634 | 0.72 | KDM4E (0.43) | ALDH1A1TSHRLMNAKDM4EHPGD | |
| SCHEMBL21660737 | 0.72 | KDM4E (0.47) | ALDH1A1TSHRLMNAKDM4EHPGD | |
| SCHEMBL21660523 | 0.72 | MEN1 (0.42) | ALDH1A1KDM4EHPGDHSD17B10MAPT | |
| SCHEMBL1310255 | 0.72 | IMPDH2 (0.64) | ALDH1A1TSHRLMNAKDM4ENPC1 |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113999250-A | Isoleucinine analogue prepared from ofloxacin as raw material, and preparation method and application thereof | 郑州工业应用技术学院 | 2022-02-01 | — | — | CN | claimed |
| CN-119157137-A | Application of isolobal rattan alkali derivative | 广西田园生化股份有限公司 | 2024-12-20 | — | — | CN | disclosed |
| CN-118355912-A | Application of D-ring-removed derivative of sinomenine in preventing and treating plant pathogenic bacteria and human pathogenic bacteria | 兰州大学 | 2024-07-19 | — | — | CN | disclosed |
| CN-117959299-A | Application of isoleucine derivative in prevention and treatment of cow mastitis pathogenic bacteria | 兰州大学 | 2024-05-03 | — | — | CN | disclosed |
| CN-114276369-A | Isoleucinine analogs, preparation method and application of isoleucinine analogs from rufloxacin to isoleucinine analogs | 河南大学 | 2022-04-05 | — | — | CN | disclosed |
| CN-114276346-A | Isochrysine analogue, preparation method and application of isochrysine analogue from fleroxacin | 河南大学 | 2022-04-05 | — | — | CN | disclosed |
| CN-113214252-B | Synthesis method of 6-phenyl-7- (pyridine-2-yl) -7H-indolo [2,3-c ] quinoline compound | 常州大学 | 2022-02-11 | — | — | CN | disclosed |
| CN-113968857-A | Isochrysine analogue prepared from enoxacin as raw material and preparation method and application thereof | 郑州工业应用技术学院 | 2022-01-25 | — | — | CN | disclosed |
| CN-113956251-A | Isoleucinine analogs, preparation method and application of isoleucinine analogs from lomefloxacin | 河南大学 | 2022-01-21 | — | — | CN | disclosed |