Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.54 |
| ▸ | TSHR | P16473 | 2/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.51 |
| ▸ | MEN1 | O00255 | 2/20 | 0.51 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.51 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.49 |
| ▸ | NOS3 | P29474 | 5/20 | 0.47 |
| ▸ | NOS1 | P29475 | 5/20 | 0.47 |
| ▸ | NOS2 | P35228 | 5/20 | 0.47 |
| ▸ | CXCR3 | P49682 | 4/20 | 0.47 |
| ▸ | RECQL | P46063 | 1/20 | 0.45 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.44 |
| ▸ | USP2 | O75604 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL27340771 | 0.79 | KDM4E (0.52) | KDM4ENOS3NOS1NOS2CXCR3 | |
| SCHEMBL30902425 | 0.79 | KDM4E (0.52) | KDM4ENOS3NOS1NOS2CXCR3 | |
| SCHEMBL8388805 | 0.77 | TSHR (0.66) | ALDH1A1KDM4ETSHRMAPK1MEN1 | |
| SCHEMBL16795274 | 0.75 | PARP1 (0.38) | ALDH1A1KDM4ETSHRALOX15SMN1; SMN2 | |
| SCHEMBL18753544 | 0.75 | SMN1; SMN2 (0.50) | ALDH1A1KDM4ETSHRMAPK1MEN1 | |
| SCHEMBL27786410 | 0.75 | CYP2A13 (0.67) | ALDH1A1KDM4ETSHRMAPK1MEN1 | |
| Succinic Acid SCHEMBL31581209 | 0.75 | DRD2 (0.49) | KDM4EMAPTHIF1A | |
| Fumaric Acid SCHEMBL31581190 | 0.74 | DRD2 (0.49) | ALDH1A1KDM4ESMN1; SMN2LMNAMAPT | |
| SCHEMBL17753689 | 0.74 | CXCR4 (0.63) | ALDH1A1KDM4EMEN1KMT2ASMN1; SMN2 | |
| SCHEMBL16795175 | 0.73 | KDM4E (0.70) | ALDH1A1KDM4ETSHRSMN1; SMN2CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2015086693-A1 | PYRAZOLOPYRIMIDIN-2-YL DERIVATIVES AS JAK INHIBITORS | ALMIRALL, S.A. (ES) | 2015-06-18 | — | — | WO | disclosed |