Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A3 | Q01959 | 8/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 6/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | GMNN | O75496 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.35 |
| ▸ | TFPI2 | P48307 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.35 |
| ▸ | THPO | P40225 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | PPM1B | O75688 | 1/20 | 0.32 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.32 |
| ▸ | PPP1CC | P36873 | 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 | |
|---|---|---|---|---|
| SCHEMBL26490661 | 0.82 | CHRM2 (0.39) | SLC6A3SLC6A4TSHRMEN1KMT2A | |
| SCHEMBL15147132 | 0.78 | CHRM2 (0.43) | SLC6A3SLC6A4MEN1KMT2APPM1B | |
| SCHEMBL92305 | 0.78 | SLC6A3 (0.33) | SLC6A3SLC6A4MEN1KMT2A | |
| SCHEMBL92249 | 0.77 | SLC6A3 (0.37) | SLC6A3SLC6A4 | |
| SCHEMBL12087836 | 0.77 | CHRM2 (0.48) | SLC6A3SLC6A4 | |
| SCHEMBL15147139 | 0.75 | ALDH1A1 (0.35) | SLC6A3SLC6A4 | |
| SCHEMBL9696637 | 0.75 | PPM1B (0.41) | SLC6A3SLC6A4MEN1KMT2APPM1B | |
| SCHEMBL10159786 | 0.74 | SLC6A3 (0.33) | SLC6A3SLC6A4 | |
| SCHEMBL10947768 | 0.73 | MEN1 (0.35) | SLC6A3SLC6A4MEN1KMT2A | |
| SCHEMBL15113823 | 0.73 | SLC6A3 (0.35) | SLC6A3GMNNLMNAPMP22TP53 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0487673-A1 | NEW XANTHINE DERIVATIVES | BOEHRINGER INGELHEIM INTERNATIONAL GmbH (DE) | 1992-06-03 | — | — | EP | disclosed |
| WO-1992000297-A1 | NEW XANTHINE DERIVATIVES | BOEHRINGER INGELHEIM KG (DE) | 1992-01-09 | — | — | WO | disclosed |