Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | KCNE1 | P15382 | 1/20 | 0.41 |
| ▸ | CCR1 | P32246 | 1/20 | 0.41 |
| ▸ | KCNQ1 | P51787 | 1/20 | 0.41 |
| ▸ | CALCA | P06881 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | ERCC1 | P07992 | 1/20 | 0.39 |
| ▸ | FEN1 | P39748 | 1/20 | 0.39 |
| ▸ | ERCC4 | Q92889 | 1/20 | 0.39 |
| ▸ | LIPG | Q9Y5X9 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL2205364 | 0.88 | KCNH2 (0.51) | KCNH2CYP2C9MAPTSMN1; SMN2KCNE1 | |
| SCHEMBL2205290 | 0.87 | CYP2C9 (0.58) | KCNH2CYP2C9MAPTSMN1; SMN2KCNE1 | |
| SCHEMBL2204180 | 0.85 | KCNH2 (0.49) | KCNH2CYP2C9MAPTSMN1; SMN2KCNE1 | |
| SCHEMBL2208272 | 0.84 | KCNH2 (0.53) | KCNH2CYP2C9MAPTSMN1; SMN2KCNE1 | |
| SCHEMBL2204798 | 0.81 | MAPT (0.51) | KCNH2CYP2C9MAPTSMN1; SMN2KCNE1 | |
| SCHEMBL2203924 | 0.79 | KCNH2 (0.51) | KCNH2CYP2C9MAPTSMN1; SMN2KCNE1 | |
| SCHEMBL2207896 | 0.79 | CYP2C9 (0.57) | KCNH2CYP2C9MAPTSMN1; SMN2KCNE1 | |
| SCHEMBL1750602 | 0.78 | MAPT (0.63) | KCNH2CYP2C9MAPTCALCAGAA | |
| SCHEMBL1376535 | 0.78 | MAPT (0.61) | KCNH2CYP2C9MAPTCALCAGAA | |
| SCHEMBL5537328 | 0.78 | KCNH2 (0.51) | KCNH2CYP2C9MAPTSMN1; SMN2KCNE1 |
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-1866313-A1 | HIV INTEGRASE INHIBITORS | Istituto di Richerche di Biologia Molecolare P. Angeletti S.p.A. (IT) | 2007-12-19 | — | — | EP | claimed |
| WO-2006103399-A1 | HIV INTEGRASE INHIBITORS | ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P ANGELETTI SPA (IT) | 2006-10-05 | — | — | WO | claimed |