Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.68 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.65 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.65 |
| ▸ | HTT | P42858 | 2/20 | 0.61 |
| ▸ | MAPT | P10636 | 1/20 | 0.61 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.56 |
| ▸ | VNN1 | O95497 | 1/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.52 |
| ▸ | POLB | P06746 | 2/20 | 0.50 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.50 |
| ▸ | CCR2 | P41597 | 1/20 | 0.50 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.50 |
| ▸ | PDE2A | O00408 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL6398126 | 0.91 | CHRNB2 (0.59) | ALDH1A1CHRNB2CHRNA4HTTMAPT | |
| SCHEMBL13850152 | 0.83 | CHRNB2 (0.65) | ALDH1A1CHRNB2CHRNA4HTTMAPT | |
| SCHEMBL12250 | 0.83 | CHRNB2 (0.65) | ALDH1A1CHRNB2CHRNA4HTTMAPT | |
| SCHEMBL13212690 | 0.83 | CHRNB2 (0.65) | ALDH1A1CHRNB2CHRNA4HTTMAPT | |
| SCHEMBL12449679 | 0.83 | CHRNB2 (0.65) | ALDH1A1CHRNB2CHRNA4HTTMAPT | |
| SCHEMBL27196354 | 0.83 | CHRNB2 (0.65) | ALDH1A1CHRNB2CHRNA4HTTMAPT | |
| SCHEMBL5205368 | 0.82 | ALDH1A1 (1.00) | ALDH1A1HTTKDM4EPOLBTSHR | |
| SCHEMBL1552926 | 0.82 | ALDH1A1 (1.00) | ALDH1A1HTTKDM4EPOLBTSHR | |
| SCHEMBL1787570 | 0.82 | ALDH1A1 (1.00) | ALDH1A1HTTKDM4EPOLBTSHR | |
| SCHEMBL12424313 | 0.81 | CHRNB2 (0.61) | ALDH1A1CHRNB2CHRNA4HTTMAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116623186-A | Corrosion inhibitor for inhibiting electrochemical corrosion and preparation method thereof | 范斌磊 | 2023-08-22 | — | — | CN | claimed |
| CN-116623186-A | Corrosion inhibitor for inhibiting electrochemical corrosion and preparation method thereof | 范斌磊 | 2023-08-22 | — | — | CN | disclosed |