Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2B | P41595 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | ELANE | P08246 | 3/20 | 0.32 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.32 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 5/20 | 0.32 |
| ▸ | VKORC1 | Q9BQB6 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9201359 | 0.88 | CYP2C9 (0.33) | HTR2BSMN1; SMN2CYP2C9VKORC1LMNA | |
| SCHEMBL6174391 | 0.87 | HTR2B (0.46) | HTR2BNPC1RAB9ASMN1; SMN2MTNR1A | |
| SCHEMBL6173304 | 0.87 | HTR2B (0.43) | HTR2BNPC1RAB9ASMN1; SMN2ELANE | |
| SCHEMBL6174697 | 0.85 | HTR2B (0.43) | HTR2BNPC1RAB9ASMN1; SMN2CYP2C9 | |
| SCHEMBL9194038 | 0.85 | CYP2C9 (0.38) | ELANECYP2C9VKORC1MAPT | |
| SCHEMBL9199339 | 0.84 | ELANE (0.47) | NPC1RAB9ASMN1; SMN2ELANEMAPT | |
| SCHEMBL9201135 | 0.84 | ELANE (0.47) | NPC1RAB9ASMN1; SMN2ELANEMAPT | |
| SCHEMBL9199422 | 0.84 | CYP2C9 (0.35) | ELANECYP2C9VKORC1MAPT | |
| SCHEMBL6174860 | 0.83 | ELANE (0.33) | HTR2BELANECYP2C9VKORC1MAPT | |
| SCHEMBL6175617 | 0.83 | ELANE (0.33) | HTR2BRAB9AELANECYP2C9VKORC1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0729466-A1 | PYRONE DERIVATIVES AS PROTEASE INHIBITORS AND ANTIVIRAL AGENTS | PARKE, DAVIS & COMPANY (US) | 1996-09-04 | — | — | EP | disclosed |
| WO-1995014014-A2 | PYRONE DERIVATIVES AS PROTEASE INHIBITORS AND ANTIVIRAL AGENTS | PARKE, DAVIS & COMPANY (US) | 1995-05-26 | — | — | WO | disclosed |