Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | CA1 | P00915 | 3/20 | 0.48 |
| ▸ | CA2 | P00918 | 3/20 | 0.48 |
| ▸ | CA4 | P22748 | 3/20 | 0.48 |
| ▸ | CA6 | P23280 | 3/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | PTGS1 | P23219 | 8/20 | 0.44 |
| ▸ | PTGS2 | P35354 | 8/20 | 0.43 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | HSPA5 | P11021 | 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 | |
|---|---|---|---|---|
| SCHEMBL4726814 | 1.00 | KDM4E (0.49) | KDM4ECA1CA2CA4CA6 | |
| SCHEMBL11795780 | 0.98 | CA1 (0.50) | KDM4ECA1CA2CA4CA6 | |
| SCHEMBL8005964 | 0.82 | CA1 (0.54) | KDM4ECA1CA2CA4CA6 | |
| SCHEMBL29169540 | 0.81 | CA1 (0.48) | KDM4ECA1CA2CA4CA6 | |
| SCHEMBL29169535 | 0.81 | CA1 (0.48) | KDM4ECA1CA2CA4CA6 | |
| SCHEMBL30564327 | 0.81 | KDM4E (0.46) | KDM4ECA1CA2CA4CA6 | |
| SCHEMBL2488144 | 0.81 | PTGS1 (0.51) | KDM4ECA1CA2CA4CA6 | |
| SCHEMBL14174043 | 0.81 | CYP26A1 (0.46) | KDM4ECA1CA2CA4CA6 | |
| SCHEMBL11791938 | 0.81 | CA1 (0.48) | KDM4ECA1CA2CA4CA6 | |
| SCHEMBL11558757 | 0.81 | KDM4E (0.46) | KDM4ECA1CA2CA4CA6 |
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-1892042-A1 | Proline derivatives supported on polymers through triazole or tetrazole linkers for organocatalytic applications | Institut Catala D'Investigacio Quimica (ES) | 2008-02-27 | — | — | EP | disclosed |