Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.39 |
| ▸ | BRD4 | O60885 | 2/20 | 0.39 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | NOX1 | Q9Y5S8 | 1/20 | 0.34 |
| ▸ | MYC | P01106 | 2/20 | 0.33 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | CES1 | P23141 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL27628909 | 0.80 | PTPN1 (0.44) | MYCNR4A1CES1 | |
| SCHEMBL14406020 | 0.68 | ALDH1A1 (0.39) | KMT2AMEN1NPSR1L3MBTL1BRD4 | |
| SCHEMBL28031070 | 0.68 | MEN1 (0.34) | KMT2AMEN1NPSR1L3MBTL1BRD4 | |
| SCHEMBL3308632 | 0.65 | MAOA (0.42) | KMT2AMEN1L3MBTL1GAAKDM4E | |
| SCHEMBL279655 | 0.65 | ALDH1A1 (0.53) | KMT2AMEN1L3MBTL1BRD4GAA | |
| SCHEMBL17028318 | 0.64 | POLB (0.48) | KMT2AMEN1KDM4EALDH1A1TSHR | |
| SCHEMBL7119411 | 0.64 | KDM4E (0.55) | KMT2AMEN1L3MBTL1BRD4GAA | |
| SCHEMBL38573232 | 0.64 | KDM4E (0.55) | KMT2AMEN1L3MBTL1BRD4GAA | |
| SCHEMBL7301325 | 0.64 | ALDH1A1 (0.45) | KMT2AMEN1L3MBTL1BRD4GAA | |
| SCHEMBL7301332 | 0.64 | THRB (0.50) | KMT2AMEN1L3MBTL1SMN1; 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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101503408-A | 8-(3-amino-piperidin-1-yl)-xanthines | BOEHRINGER INGELHEIM PHARMA (DE) | 2009-08-12 | — | — | CN | disclosed |
| CN-101503409-A | 8-(3-amino-piperidin-1-yl)-xanthines, the production thereof and the use of the same as medicaments | BOEHRINGER INGELHEIM PHARMA (DE) | 2009-08-12 | — | — | CN | disclosed |
| CN-100522962-C | 8- [ 3-amino-piperidin-1-yl ] -xanthines, process for their preparation and their use as pharmaceutical preparations | BOEHRINGER INGELHEIM PHARMA (DE) | 2009-08-05 | — | — | CN | disclosed |
| CN-1675212-A | 8- [ 3-amino-piperidin-1-yl ] -xanthines, process for their preparation and their use as pharmaceutical preparations | BOEHRINGER INGELHEIM PHARMA (DE) | 2005-09-28 | — | — | CN | disclosed |