Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 1/20 | 0.66 |
| ▸ | TLR7 | Q9NYK1 | 8/20 | 0.58 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.43 |
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.42 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.41 |
| ▸ | HTR6 | P50406 | 2/20 | 0.41 |
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 SCHEMBL7301486 | 0.78 | HTR2C (0.45) | HTR2CTLR7TLR9PIK3CDHTR6 | |
| SCHEMBL30586386 | 0.75 | NPC1 (0.52) | HPGDNPC1RAB9ASMN1; SMN2ADORA2A | |
| SCHEMBL7291502 | 0.74 | HTR2C (0.68) | HTR2CTLR7TLR9HRH4ADORA2A | |
| Hydrochloric Acid SCHEMBL7318062 | 0.73 | HTR2C (0.66) | HTR2CTLR7TLR9HRH4ADORA2A | |
| SCHEMBL1798270 | 0.72 | ADORA2A (0.72) | ADORA2A | |
| SCHEMBL30586396 | 0.72 | NPC1 (0.56) | HPGDNPC1RAB9ASMN1; SMN2ADORA2A | |
| SCHEMBL463396 | 0.72 | NPC1 (0.52) | HPGDNPC1RAB9ASMN1; SMN2ADORA2A | |
| SCHEMBL6288387 | 0.72 | NPC1 (0.52) | HPGDNPC1RAB9ASMN1; SMN2ADORA2A | |
| SCHEMBL23977303 | 0.72 | HTR2C (0.57) | HTR2CTLR7TLR9HPGDHRH4 | |
| SCHEMBL30291239 | 0.72 | HTR2C (0.57) | HTR2CTLR7TLR9HPGDHRH4 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0300726-B1 | PIPERAZINYL DERIVATES OF PURINES AND ISOSTERES THEREOF AS HYPOGLYCEMIC AGENTS | MERCK & CO. INC. (US) | 1993-09-22 | — | — | EP | disclosed |
| US-5057517-A | Piperazinyl derivatives of purines and isosteres thereof as hypoglycemic agents | MERCK & CO., INC. (US) | 1991-10-15 | — | — | US | disclosed |
| EP-0300726-A1 | Piperazinyl derivates of purines and isosteres thereof as hypoglycemic agents | MERCK & CO. INC. (US) | 1989-01-25 | — | — | EP | disclosed |