Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | POLB | P06746 | 2/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.33 |
| ▸ | DRD2 | P14416 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | BRD4 | O60885 | 1/20 | 0.31 |
| ▸ | PARP1 | P09874 | 1/20 | 0.31 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.31 |
| ▸ | CREBBP | Q92793 | 2/20 | 0.31 |
| ▸ | NOTUM | Q6P988 | 2/20 | 0.31 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.30 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.30 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL27896674 | 0.82 | PTPN1 (0.39) | ALDH1A1POLBL3MBTL1TDP1 | |
| SCHEMBL28138277 | 0.73 | PDGFRB (0.38) | MEN1KMT2AALDH1A1RAB9AKDM4E | |
| SCHEMBL27628921 | 0.70 | MEN1 (0.33) | MEN1KMT2ANPSR1ALDH1A1POLB | |
| SCHEMBL27628926 | 0.68 | KMT2A (0.41) | MEN1KMT2ANPSR1ALDH1A1L3MBTL1 | |
| SCHEMBL12531910 | 0.64 | HDAC4 (0.47) | MEN1KMT2AALDH1A1L3MBTL1KDM4E | |
| SCHEMBL14406020 | 0.63 | ALDH1A1 (0.39) | MEN1KMT2ANPSR1ALDH1A1POLB | |
| SCHEMBL28311081 | 0.61 | KDM4E (0.36) | MEN1KMT2ANPSR1ALDH1A1KDM4E | |
| Acetaldehyde SCHEMBL27408136 | 0.61 | ALDH1A1 (0.44) | MEN1KMT2AALDH1A1POLBL3MBTL1 | |
| SCHEMBL28138836 | 0.60 | POLB (0.35) | MEN1KMT2ANPSR1ALDH1A1POLB | |
| SCHEMBL28215494 | 0.60 | ERN1 (0.45) | MEN1KMT2AALDH1A1POLBL3MBTL1 |
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 5 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 |