Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 4/20 | 0.37 |
| ▸ | EP300 | Q09472 | 1/20 | 0.35 |
| ▸ | CTRB1 | P17538 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.33 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.33 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.33 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | MAOB | P27338 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7616998 | 0.90 | ABCC4 (0.37) | CES2GAALMNACA2 | |
| SCHEMBL7663904 | 0.73 | CES2 (0.36) | CES2EP300CTRB1HDAC8DDB1 | |
| SCHEMBL14108389 | 0.69 | CES2 (0.39) | CES2EP300HDAC8DDB1CRBN | |
| SCHEMBL10475464 | 0.69 | CALM1 (0.39) | — | |
| SCHEMBL9199437 | 0.67 | EP300 (0.39) | CES2EP300DDB1CRBNTLR9 | |
| SCHEMBL11685932 | 0.67 | CTRB1 (0.41) | CES2EP300CTRB1TLR9MAOB | |
| SCHEMBL11541427 | 0.63 | HTR6 (0.37) | — | |
| SCHEMBL6206465 | 0.63 | TLR9 (0.40) | CES2EP300CTRB1GAALMNA | |
| SCHEMBL29079479 | 0.63 | CA2 (0.47) | LMNAMAPTCA2MAOB | |
| SCHEMBL5967437 | 0.63 | TLR9 (0.40) | CES2EP300CTRB1GAALMNA |
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 |
|---|---|---|---|---|---|---|---|
| US-6436933-B1 | 1-HYDROXY-3-(2-METHYLPROPYL)-5,6-DIPHENYLHYDROPYRAZIN-2-ONE | STRUCTURAL BIOINFORMATICS INC. | 2002-08-20 | — | — | US | disclosed |