Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOX1 | Q9Y5S8 | 1/20 | 0.47 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.44 |
| ▸ | MAPT | P10636 | 4/20 | 0.44 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.43 |
| ▸ | MEN1 | O00255 | 3/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | ATM | Q13315 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | RAD51 | Q06609 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.41 |
| ▸ | EGFR | P00533 | 1/20 | 0.41 |
| ▸ | MMP1 | P03956 | 1/20 | 0.41 |
| ▸ | MMP2 | P08253 | 1/20 | 0.41 |
| ▸ | MMP9 | P14780 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL4789929 | 0.87 | ALDH1A1 (0.46) | NOX1ALDH1A1MAPTHTTLMNA | |
| SCHEMBL13006826 | 0.82 | MAPT (0.50) | ALDH1A1MAPTALOX12HTTLMNA | |
| SCHEMBL21087845 | 0.79 | NOX1 (0.47) | NOX1TRPV1ALDH1A1MAPTALOX12 | |
| Phenyl 4-Chlorophenylcarbamate SCHEMBL6258165 | 0.79 | ALDH1A1 (0.70) | TRPV1ALDH1A1MAPTHTTLMNA | |
| SCHEMBL16192920 | 0.79 | NOX1 (0.56) | NOX1TRPV1ALDH1A1MAPTALOX12 | |
| SCHEMBL5406539 | 0.73 | SMN1; SMN2 (0.64) | TRPV1ALDH1A1MAPTALOX12HTT | |
| SCHEMBL2701806 | 0.73 | KMT2A (0.60) | TRPV1ALDH1A1MAPTHTTLMNA | |
| SCHEMBL12845610 | 0.72 | MAPT (0.53) | ALDH1A1MAPTALOX12LMNAKMT2A | |
| SCHEMBL3086433 | 0.72 | LTA4H (0.39) | ALDH1A1MAPTKMT2AMEN1ATM | |
| SCHEMBL8065643 | 0.71 | ALDH1A1 (0.70) | TRPV1ALDH1A1MAPTHTTLMNA |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2019179362-A1 | AMIDINE AND GUANIDINE DERIVATIVES, PREPARATION METHOD THEREFOR AND MEDICAL USES THEREOF | 四川科伦博泰生物医药股份有限公司 | 2019-09-26 | — | — | WO | disclosed |