Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK1 | P06493 | 1/20 | 0.50 |
| ▸ | PDE8A | O60658 | 2/20 | 0.48 |
| ▸ | ADCY5 | O95622 | 3/20 | 0.48 |
| ▸ | HDAC1 | Q13547 | 6/20 | 0.47 |
| ▸ | HDAC2 | Q92769 | 5/20 | 0.47 |
| ▸ | HPRT1 | P00492 | 3/20 | 0.46 |
| ▸ | HDAC3 | O15379 | 4/20 | 0.45 |
| ▸ | HDAC4 | P56524 | 4/20 | 0.45 |
| ▸ | HDAC7 | Q8WUI4 | 4/20 | 0.45 |
| ▸ | HDAC10 | Q969S8 | 4/20 | 0.45 |
| ▸ | HDAC11 | Q96DB2 | 4/20 | 0.45 |
| ▸ | HDAC8 | Q9BY41 | 4/20 | 0.45 |
| ▸ | HDAC6 | Q9UBN7 | 4/20 | 0.45 |
| ▸ | HDAC9 | Q9UKV0 | 4/20 | 0.45 |
| ▸ | HDAC5 | Q9UQL6 | 4/20 | 0.45 |
| ▸ | YTHDC1 | Q96MU7 | 2/20 | 0.45 |
| ▸ | CFTR | P13569 | 1/20 | 0.43 |
| ▸ | P2RY1 | P47900 | 1/20 | 0.43 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL19633358 | 0.93 | CDK1 (0.52) | CDK1PDE8AADCY5HDAC1HDAC2 | |
| SCHEMBL28654978 | 0.83 | HDAC1 (0.53) | ADCY5HDAC1HDAC2HPRT1HDAC3 | |
| SCHEMBL24476374 | 0.83 | HDAC1 (0.53) | ADCY5HDAC1HDAC2HPRT1HDAC3 | |
| SCHEMBL19553686 | 0.80 | CDK1 (0.49) | CDK1PDE8AADCY5HDAC1HDAC2 | |
| SCHEMBL14024978 | 0.79 | ADORA2A (0.62) | CDK1PDE8AHDAC1HDAC2 | |
| SCHEMBL19553552 | 0.79 | HDAC1 (0.47) | CDK1PDE8AADCY5HDAC1HDAC2 | |
| SCHEMBL3441032 | 0.78 | CDK1 (0.59) | CDK1PDE8AHDAC1HDAC2 | |
| SCHEMBL30661711 | 0.78 | ADORA2A (0.57) | CDK1PDE8ACFTR | |
| SCHEMBL19553494 | 0.78 | ADORA2A (0.57) | CDK1PDE8ACFTR | |
| SCHEMBL6045668 | 0.78 | ADCY5 (0.72) | ADCY5 |
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-2017197624-A1 | PURINE-SCAFFOLD TLR7 LIGANDS AND CONJUGATE THEREOF | SHENZHEN HORNETCORN BIOTECHNOLOGY COMPANY,CO., LTD (CN) | 2017-11-23 | — | — | WO | disclosed |