Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PI4KA | P42356 | 4/20 | 0.61 |
| ▸ | PI4K2B | Q8TCG2 | 4/20 | 0.61 |
| ▸ | PI4K2A | Q9BTU6 | 4/20 | 0.61 |
| ▸ | PI4KB | Q9UBF8 | 4/20 | 0.61 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.61 |
| ▸ | BLM | P54132 | 2/20 | 0.61 |
| ▸ | TP53 | P04637 | 1/20 | 0.61 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.61 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.61 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.61 |
| ▸ | MEN1 | O00255 | 1/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.61 |
| ▸ | APEX1 | P27695 | 1/20 | 0.61 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.61 |
| ▸ | ADCY1 | Q08828 | 1/20 | 0.61 |
| ▸ | ADORA2A | P29274 | 4/20 | 0.60 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.57 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.57 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.57 |
| ▸ | ADA | P00813 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL20794210 | 1.00 | PI4KA (0.61) | PI4KAPI4K2BPI4K2API4KBNFKB1 | |
| SCHEMBL24499895 | 1.00 | PI4KA (0.61) | PI4KAPI4K2BPI4K2API4KBNFKB1 | |
| SCHEMBL7151977 | 1.00 | PI4KA (0.61) | PI4KAPI4K2BPI4K2API4KBNFKB1 | |
| SCHEMBL12832016 | 1.00 | PI4KA (0.61) | PI4KAPI4K2BPI4K2API4KBNFKB1 | |
| SCHEMBL13690449 | 0.83 | PI4KA (0.61) | PI4KAPI4K2BPI4K2API4KBNFKB1 | |
| SCHEMBL22820040 | 0.83 | CYP2C19 (0.42) | PI4KAPI4K2BPI4K2API4KBNFKB1 | |
| SCHEMBL13939562 | 0.83 | PI4KA (0.57) | PI4KAPI4K2BPI4K2API4KBNFKB1 | |
| SCHEMBL7162148 | 0.83 | PI4KA (0.57) | PI4KAPI4K2BPI4K2API4KBNFKB1 | |
| SCHEMBL19242531 | 0.81 | ADORA3 (0.42) | PI4KAPI4K2BPI4K2API4KBNFKB1 | |
| SCHEMBL19941993 | 0.81 | PI4KA (0.59) | PI4KAPI4K2BPI4K2API4KBNFKB1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6132957-A | CONTACTING A 9-SUBSTITUTED ADENINE WITH A CELL EXTRACT CONTAINING ADENYLATE CYCLASE ACTIVITY, DETECTING THE AMOUNT OF INHIBITION, AND CORRELATING WITH TEST STANDARD OR CONTROL; NOVEL THERAPIES FOR CARDIOVASCULAR DISORDERS | THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK | 2000-10-17 | — | — | US | disclosed |
| US-5795756-A | Method and compounds for the inhibition of adenylyl cyclase | THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YORK | 1998-08-18 | — | — | US | disclosed |