Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 6/20 | 0.50 |
| ▸ | ITGA2B | P08514 | 6/20 | 0.50 |
| ▸ | ITGAV | P06756 | 1/20 | 0.46 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.46 |
| ▸ | BRD4 | O60885 | 1/20 | 0.46 |
| ▸ | CCKBR | P32239 | 1/20 | 0.45 |
| ▸ | HTR2C | P28335 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | F2 | P00734 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL3982387 | 0.93 | CCKBR (0.50) | ITGB3ITGA2BITGAVCHRM3CCKBR | |
| SCHEMBL12723408 | 0.93 | CCKBR (0.50) | ITGB3ITGA2BITGAVCHRM3CCKBR | |
| Trifluoroacetic Acid SCHEMBL13739250 | 0.91 | F2 (0.51) | ITGB3ITGA2BITGAVCHRM3CCKBR | |
| Tert-Butyl Formate SCHEMBL28284338 | 0.89 | ITGB3 (0.47) | ITGB3ITGA2BITGAVCHRM3BRD4 | |
| SCHEMBL12722664 | 0.86 | ALDH1A1 (0.50) | CCKBRHTR2CALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL5338500 | 0.86 | ALDH1A1 (0.50) | CCKBRHTR2CALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL12722614 | 0.86 | ALDH1A1 (0.50) | CCKBRHTR2CALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL3947594 | 0.85 | BRD4 (0.52) | ITGB3ITGA2BITGAVBRD4CCKBR | |
| Hydrochloric Acid SCHEMBL6307871 | 0.85 | ALDH1A1 (0.49) | CCKBRHTR2CALDH1A1LMNASMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL3947595 | 0.84 | BRD4 (0.51) | ITGB3ITGA2BITGAVBRD4CCKBR |
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-109790157-A | New antimicrobial compound | 方济各安吉利克化学联合股份有限公司 | 2019-05-21 | — | — | CN | disclosed |
| CN-109415373-A | New antimicrobial compound | 方济各安吉利克化学联合股份有限公司 | 2019-03-01 | — | — | CN | disclosed |