Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 3/20 | 0.61 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.52 |
| ▸ | SDHB | P21912 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | CA12 | O43570 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | CA7 | P43166 | 1/20 | 0.44 |
| ▸ | XDH | P47989 | 1/20 | 0.44 |
| ▸ | CA9 | Q16790 | 1/20 | 0.44 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL31401527 | 1.00 | NOTUM (0.61) | NOTUMVCAM1SDHBKDM4ESMN1; SMN2 | |
| SCHEMBL23850281 | 0.87 | NOTUM (0.60) | NOTUMVCAM1SDHBKDM4ESMN1; SMN2 | |
| SCHEMBL8916988 | 0.86 | VCAM1 (0.54) | NOTUMVCAM1KDM4ESMN1; SMN2HSD17B10 | |
| SCHEMBL31401027 | 0.83 | CDC25B (0.45) | NOTUMSMN1; SMN2POLBPKM | |
| SCHEMBL29586404 | 0.81 | AR (0.41) | NOTUM | |
| SCHEMBL1997248 | 0.80 | NOTUM (0.73) | NOTUMKDM4ESMN1; SMN2HSD17B10ALDH1A1 | |
| SCHEMBL1110755 | 0.80 | VCAM1 (0.56) | VCAM1KDM4ESMN1; SMN2HSD17B10ALDH1A1 | |
| SCHEMBL8918126 | 0.79 | CA12 (0.65) | VCAM1KDM4ESMN1; SMN2HSD17B10ALDH1A1 | |
| SCHEMBL15763269 | 0.78 | NOTUM (0.57) | NOTUMVCAM1SDHBKDM4ESMN1; SMN2 | |
| SCHEMBL8610984 | 0.78 | CFTR (0.43) | NOTUMVCAM1SDHBKDM4ESMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| US-6156800-A | 4-fluoroalkyl-substituted benzoylguanidines, process for their preparation, their use as a medicament or diagnostic, and medicament containing them | AVENTIS PHARMA DEUTSCHLAND GMBH (DE) | 2000-12-05 | — | — | US | disclosed |
| US-5747539-A | Fluorine-containing benzoylguanidines | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1998-05-05 | — | — | US | disclosed |