Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 18/20 | 0.79 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.79 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.55 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.55 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.55 |
| ▸ | MEN1 | O00255 | 1/20 | 0.55 |
| ▸ | POLB | P06746 | 1/20 | 0.55 |
| ▸ | MAPT | P10636 | 1/20 | 0.55 |
| ▸ | TSHR | P16473 | 1/20 | 0.55 |
| ▸ | PPARG | P37231 | 1/20 | 0.55 |
| ▸ | SMAD3 | P84022 | 1/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.55 |
| ▸ | NCOA2 | Q15596 | 1/20 | 0.55 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.55 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.55 |
| ▸ | HPGD | P15428 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL3699454 | 0.93 | ADORA1 (0.81) | ADORA1SLC6A3KDM4EALDH1A1NPSR1 | |
| SCHEMBL1177362 | 0.93 | ADORA1 (0.81) | ADORA1SLC6A3 | |
| Hydrochloric Acid SCHEMBL3698557 | 0.92 | ADORA1 (0.79) | ADORA1SLC6A3KDM4EALDH1A1NPSR1 | |
| SCHEMBL13945016 | 0.92 | ADORA1 (0.76) | ADORA1SLC6A3KDM4EALDH1A1NPSR1 | |
| SCHEMBL7642574 | 0.92 | ADORA1 (0.78) | ADORA1SLC6A3KDM4EALDH1A1NPSR1 | |
| SCHEMBL3710188 | 0.91 | ADORA1 (0.77) | ADORA1SLC6A3KDM4EALDH1A1NPSR1 | |
| SCHEMBL13938560 | 0.91 | ADORA1 (0.77) | ADORA1SLC6A3 | |
| SCHEMBL13937445 | 0.91 | ADORA1 (0.77) | ADORA1SLC6A3 | |
| SCHEMBL3707223 | 0.90 | ADORA1 (0.74) | ADORA1SLC6A3KDM4EALDH1A1NPSR1 | |
| SCHEMBL3703461 | 0.90 | ADORA1 (0.74) | ADORA1SLC6A3KDM4EALDH1A1MEN1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2009015811-A1 | DIPEPTOID PRODRUGS AND THE USE THEREOF | BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) | 2009-02-05 | — | — | WO | disclosed |