Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.38 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | RGS12 | O14924 | 2/20 | 0.33 |
| ▸ | USP2 | O75604 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | KEAP1 | Q14145 | 2/20 | 0.33 |
| ▸ | NFE2L2 | Q16236 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | BLM | P54132 | 1/20 | 0.33 |
| ▸ | EEF2K | O00418 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | CDK1 | P06493 | 1/20 | 0.30 |
| ▸ | CDK4 | P11802 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL1945401 | 0.93 | ADORA3 (0.46) | ADORA3ADORA2BTSHRRGS12USP2 | |
| SCHEMBL1944180 | 0.92 | TSHR (0.48) | ADORA3ADORA2BTSHRRGS12USP2 | |
| SCHEMBL1943200 | 0.91 | ADORA3 (0.35) | ADORA3ADORA2BTSHRRGS12USP2 | |
| SCHEMBL1945510 | 0.87 | PIK3CA (0.36) | ADORA3ADORA2B | |
| SCHEMBL1945285 | 0.84 | PIK3CA (0.36) | ADORA3ADORA2B | |
| SCHEMBL17364395 | 0.78 | TSHR (0.41) | ADORA3ADORA2BTSHRRGS12USP2 | |
| SCHEMBL18989531 | 0.75 | TSHR (0.39) | ADORA3ADORA2BTSHRRGS12USP2 | |
| SCHEMBL1546118 | 0.72 | ALDH1A1 (0.49) | ADORA3ADORA2BTSHRMEN1KMT2A | |
| SCHEMBL9427216 | 0.71 | NPSR1 (0.37) | USP2KDM4EHTTMEN1KMT2A | |
| SCHEMBL1946298 | 0.71 | TSHR (0.50) | ADORA3ADORA2BTSHRRGS12USP2 |
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-9221821-B2 | Methods for the synthesis of 1,3-substituted aminouracils and other xanthine-related compounds | Forest Laboratories Holdings, Limited (BM) | 2015-12-29 | — | — | US | disclosed |
| US-9221821-B2 | Methods for the synthesis of 1,3-substituted aminouracils and other xanthine-related compounds | Forest Laboratories Holdings, Limited (BM) | 2015-12-29 | — | — | US | disclosed |