Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BIRC2 | Q13490 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.33 |
| ▸ | PARP1 | P09874 | 1/20 | 0.32 |
| ▸ | CCR2 | P41597 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 2/20 | 0.32 |
| ▸ | CA2 | P00918 | 2/20 | 0.32 |
| ▸ | CA4 | P22748 | 2/20 | 0.32 |
| ▸ | CA9 | Q16790 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | XIAP | P98170 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL9036872 | 0.78 | CCR2 (0.36) | BIRC2CCR2KCNH2 | |
| SCHEMBL511620 | 0.75 | — | — | |
| SCHEMBL292193 | 0.72 | LTA4H (0.30) | — | |
| SCHEMBL16508867 | 0.72 | SMN1; SMN2 (0.41) | KDM4ESIGMAR1MAPTSMN1; SMN2 | |
| SCHEMBL31053474 | 0.70 | GRM2 (0.41) | BIRC2KDM4EKCNH2MAPTXIAP | |
| SCHEMBL294449 | 0.70 | CXCR4 (0.33) | — | |
| SCHEMBL28853916 | 0.69 | BIRC2 (0.37) | BIRC2SIGMAR1CA1CA2CA4 | |
| SCHEMBL26814632 | 0.69 | CHRNB2 (0.41) | BIRC2PARP1CA1CA2CA4 | |
| SCHEMBL20000664 | 0.69 | BIRC2 (0.38) | BIRC2CCR2KCNH2MAPTXIAP | |
| SCHEMBL7907918 | 0.69 | SLC6A3 (0.32) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2139877-B1 | DEUTERATED PIPERAZINE DERIVATIVES AS ANTI-ANGINAL COMPOUNDS | CONCERT PHARMACEUTICALS INC (US) | 2011-05-11 | — | — | EP | disclosed |