Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 5/20 | 0.49 |
| ▸ | ADORA2A | P29274 | 4/20 | 0.49 |
| ▸ | ADORA2B | P29275 | 3/20 | 0.49 |
| ▸ | CHUK | O15111 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | CYP11B2 | P19099 | 3/20 | 0.40 |
| ▸ | CNR1 | P21554 | 1/20 | 0.39 |
| ▸ | CNR2 | P34972 | 1/20 | 0.39 |
| ▸ | NT5E | P21589 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.39 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL15832010 | 0.82 | ADORA1 (0.49) | ADORA1ADORA2AADORA2BCHUKKDM4E | |
| SCHEMBL9849371 | 0.81 | CTSS (0.51) | ADORA1ADORA2AKDM4ENPSR1HPGD | |
| SCHEMBL21283227 | 0.81 | MEN1 (0.46) | ADORA1ADORA2AADORA2BCHUKKDM4E | |
| SCHEMBL2530034 | 0.79 | ADORA2B (0.47) | ADORA1ADORA2AADORA2BCHUKKDM4E | |
| SCHEMBL3290050 | 0.75 | ADORA2B (0.48) | ADORA1ADORA2AADORA2BCHUKKDM4E | |
| SCHEMBL11401495 | 0.74 | ADORA1 (0.50) | ADORA1ADORA2AADORA2BCHUKKDM4E | |
| SCHEMBL2650461 | 0.73 | CYP11B2 (0.40) | KDM4EHPGDALDH1A1CYP11B2CNR1 | |
| SCHEMBL1991506 | 0.71 | BCHE (0.46) | ADORA1ADORA2AADORA2BCHUKKDM4E | |
| SCHEMBL18357153 | 0.71 | CYP1A2 (0.47) | ADORA1ADORA2AADORA2BKDM4ERXFP1 | |
| SCHEMBL29907743 | 0.71 | ADORA1 (0.53) | ADORA1ADORA2AADORA2BCHUKKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-0446604-A2 | Pyridine and related aza heterocycle derivatives as cardiovascular agents | AMERICAN CYANAMID COMPANY (US) | 1991-09-18 | — | — | EP | disclosed |