Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | VCAM1 | P19320 | 1/20 | 0.49 |
| ▸ | SLC9A1 | P19634 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.41 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 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 | |
|---|---|---|---|---|
| SCHEMBL8896076 | 0.99 | VCAM1 (0.48) | VCAM1SLC9A1ALDH1A1L3MBTL1POLB | |
| SCHEMBL8894967 | 0.94 | VCAM1 (0.51) | VCAM1SLC9A1ALDH1A1L3MBTL1POLB | |
| SCHEMBL29825874 | 0.82 | ALDH1A1 (0.43) | VCAM1ALDH1A1POLBSMN1; SMN2NPSR1 | |
| SCHEMBL30153250 | 0.82 | ALDH1A1 (0.48) | VCAM1ALDH1A1L3MBTL1POLBSMN1; SMN2 | |
| SCHEMBL22636985 | 0.82 | ALDH1A1 (0.48) | VCAM1ALDH1A1L3MBTL1POLBSMN1; SMN2 | |
| SCHEMBL1763095 | 0.81 | SLC9A1 (0.52) | SLC9A1KDM4E | |
| SCHEMBL4946893 | 0.80 | SMN1; SMN2 (0.50) | ALDH1A1SMN1; SMN2ATMNPSR1KDM4E | |
| SCHEMBL8584027 | 0.80 | SLC9A1 (0.48) | VCAM1SLC9A1SMN1; SMN2KDM4EHSD17B10 | |
| SCHEMBL31401408 | 0.79 | SLC9A1 (0.53) | SLC9A1SMN1; SMN2KMT2ATSHR | |
| SCHEMBL8581253 | 0.78 | SLC9A1 (0.47) | VCAM1SLC9A1ALDH1A1SMN1; SMN2KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| US-5693672-A | 3,4,5-substituted benzoylguanidines, process for their preparation, their use as a medicament or diagnostic and medicament containing them | HOECHST AKTIENGESELLSCHAFT (DE) | 1997-12-02 | — | — | US | disclosed |