Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.40 |
| ▸ | KCNE1 | P15382 | 1/20 | 0.40 |
| ▸ | CCR1 | P32246 | 1/20 | 0.40 |
| ▸ | KCNQ1 | P51787 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | CALCA | P06881 | 1/20 | 0.39 |
| ▸ | CNR1 | P21554 | 1/20 | 0.39 |
| ▸ | CNR2 | P34972 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | ERCC1 | P07992 | 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 | |
|---|---|---|---|---|
| SCHEMBL5114548 | 0.86 | CALCA (0.42) | SMN1; SMN2KCNE1CCR1KCNQ1POLB | |
| SCHEMBL5129076 | 0.86 | KCNE1 (0.41) | SMN1; SMN2KCNE1CCR1KCNQ1KCNH2 | |
| SCHEMBL5120128 | 0.82 | SMN1; SMN2 (0.43) | SMN1; SMN2KCNE1CCR1KCNQ1POLB | |
| SCHEMBL5118409 | 0.82 | TLR2 (0.42) | SMN1; SMN2KCNE1CCR1KCNQ1KCNH2 | |
| SCHEMBL5119559 | 0.81 | KCNE1 (0.44) | SMN1; SMN2KCNE1CCR1KCNQ1POLB | |
| SCHEMBL5121129 | 0.81 | KCNE1 (0.44) | SMN1; SMN2KCNE1CCR1KCNQ1KCNH2 | |
| SCHEMBL5128153 | 0.79 | KCNE1 (0.46) | SMN1; SMN2KCNE1CCR1KCNQ1KCNH2 | |
| SCHEMBL5128379 | 0.78 | RXFP1 (0.41) | POLBHPGDMEN1TSHRKMT2A | |
| SCHEMBL5128477 | 0.78 | KCNH2 (0.50) | SMN1; SMN2KCNE1CCR1KCNQ1KCNH2 | |
| SCHEMBL5117833 | 0.77 | ALDH1A1 (0.42) | SMN1; SMN2KCNE1CCR1KCNQ1KCNH2 |
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-7459452-B2 | Dihydroxypyrimidine carboxamide inhibitors of HIV integrase | ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI S.P.A. (IT) | 2008-12-02 | — | — | US | claimed |