Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | GPR3 | P46089 | 1/20 | 0.47 |
| ▸ | NQO1 | P15559 | 3/20 | 0.35 |
| ▸ | KIF11 | P52732 | 1/20 | 0.33 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.33 |
| ▸ | HTR3B | O95264 | 1/20 | 0.33 |
| ▸ | HTR3A | P46098 | 1/20 | 0.33 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.33 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.33 |
| ▸ | CHRNE | Q04844 | 1/20 | 0.33 |
| ▸ | SELP | P16109 | 1/20 | 0.32 |
| ▸ | TOP2A | P11388 | 1/20 | 0.32 |
| ▸ | CTSC | P53634 | 1/20 | 0.32 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.32 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.32 |
| ▸ | BCHE | P06276 | 1/20 | 0.32 |
| ▸ | ACHE | P22303 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| Phenanthridine SCHEMBL27628928 | 0.89 | KDM4E (0.44) | KDM4EGPR3NQO1KIF11HTR3E | |
| Phenanthridine SCHEMBL27966445 | 0.84 | KDM4E (0.56) | KDM4EGPR3KIF11HTR3EHTR3B | |
| SCHEMBL28199787 | 0.83 | KIF11 (0.44) | NQO1KIF11CHRNESELPMEN1 | |
| Piperazine SCHEMBL27836342 | 0.77 | KIF11 (0.42) | NQO1KIF11CHRNE | |
| SCHEMBL17409929 | 0.77 | KIF11 (0.43) | KDM4EGPR3KIF11HTR3EHTR3B | |
| SCHEMBL7901266 | 0.73 | KIF11 (0.42) | KDM4EGPR3NQO1KIF11HTR3E | |
| Anthracene SCHEMBL28161518 | 0.72 | GNG2 (0.43) | KDM4ENQO1KIF11SELPMEN1 | |
| Naphthalen-1-Yl-Methanol SCHEMBL27558894 | 0.72 | NQO1 (0.50) | NQO1KIF11CHRNEACHE | |
| Benzyl Alcohol SCHEMBL27453002 | 0.72 | NQO1 (0.41) | NQO1KIF11ACHE | |
| SCHEMBL27584193 | 0.71 | GNG2 (0.47) | KDM4ENQO1KIF11SELPMEN1 |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102964347-B | 8-[3-amino-piperadine-1-base]-Xanthine compounds, its preparation method and the purposes as pharmaceutical preparation | BOEHRINGER INGELHEIM PHARMACEUTICAL CO., LTD. (DE) | 2015-11-18 | — | — | CN | disclosed |
| CN-105001222-A | New 8-(3-amino-piperidin-1-yl)-xanthine derivatives, preparing method and uses thereof as a pharmaceutic preparation | BOEHRINGER INGELHEIM PHARMA | 2015-10-28 | — | — | CN | disclosed |
| CN-101503409-B | 8-(3-amino-piperidin-1-yl)-xanthines, the production thereof and the use of the same as medicaments | BOEHRINGER INGELHEIM PHARMA | 2014-01-22 | — | — | CN | disclosed |
| CN-101503408-B | 8-(3-amino-piperidin-1-yl)-xanthines | BEOEHRINGER INGELHEIM PHARMA GMBH & CO KG | 2013-04-24 | — | — | CN | disclosed |
| CN-102964347-A | 8-[3-amino-piperidin-1-yl]-xanthines, the production thereof and the use of the same as medicaments | BOEHRINGER INGELHEIM PHARMA | 2013-03-13 | — | — | CN | disclosed |
| 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 |