Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4A | P27815 | 7/20 | 0.43 |
| ▸ | ADORA2A | P29274 | 7/20 | 0.43 |
| ▸ | PDE4B | Q07343 | 7/20 | 0.43 |
| ▸ | PDE4C | Q08493 | 7/20 | 0.43 |
| ▸ | PDE4D | Q08499 | 7/20 | 0.43 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.41 |
| ▸ | XDH | P47989 | 6/20 | 0.40 |
| ▸ | ADORA2B | P29275 | 3/20 | 0.40 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.39 |
| ▸ | BLM | P54132 | 1/20 | 0.39 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | PNP | P00491 | 1/20 | 0.38 |
| ▸ | CDK1 | P06493 | 1/20 | 0.37 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.37 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.37 |
| ▸ | CDK2 | P24941 | 1/20 | 0.37 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8343134 | 0.97 | PDE4A (0.41) | PDE4AADORA2APDE4BPDE4CPDE4D | |
| Hydrochloric Acid SCHEMBL8345987 | 0.73 | NPSR1 (0.39) | PDE4AADORA2APDE4BPDE4CPDE4D | |
| Hydrochloric Acid SCHEMBL9069730 | 0.71 | PNP (0.55) | ADORA2BADORA3PNPTYMP | |
| SCHEMBL9507529 | 0.66 | KDM4E (0.40) | ADORA2AXDHADORA2BADORA3CDK1 | |
| SCHEMBL3259214 | 0.65 | HRH3 (0.40) | ADORA2BHPGDHSD17B10CDK1CCNB1 | |
| SCHEMBL11270403 | 0.65 | XDH (0.62) | XDHPNPCDK1CCNB1 | |
| SCHEMBL18050875 | 0.63 | PDPK1 (0.46) | PDPK1ADORA3PNP | |
| SCHEMBL545047 | 0.62 | PI4KA (0.41) | XDHADORA2BHPGDHSD17B10CDK1 | |
| SCHEMBL3114173 | 0.62 | PDPK1 (0.59) | PDPK1HPGDADORA1 | |
| SCHEMBL8771911 | 0.62 | TYMP (0.47) | HPGDHSD17B10TYMP |
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-5948903-A | Synthesis of 3-deazapurines | ISIS PHARMACEUTICALS, INC. (US) | 1999-09-07 | — | — | US | disclosed |
| US-5750692-A | Synthesis of 3-deazapurines | ISIS PHARMACEUTICALS, INC. (US) | 1998-05-12 | — | — | US | disclosed |