Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FEN1 | P39748 | 1/20 | 0.40 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.39 |
| ▸ | RXRA | P19793 | 1/20 | 0.37 |
| ▸ | RXRB | P28702 | 1/20 | 0.37 |
| ▸ | RXRG | P48443 | 1/20 | 0.37 |
| ▸ | CTSV | O60911 | 3/20 | 0.37 |
| ▸ | CTSL | P07711 | 3/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | MGMT | P16455 | 1/20 | 0.35 |
| ▸ | BRD4 | O60885 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | HPD | P32754 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL3036535 | 0.84 | ALDH1A1 (0.37) | LMNAALDH1A1POLBHTTSMN1; SMN2 | |
| SCHEMBL3031367 | 0.70 | CYP3A4 (0.35) | — | |
| SCHEMBL7552230 | 0.70 | MGMT (0.49) | CYP19A1MGMTMEN1KMT2AMAPT | |
| SCHEMBL31190951 | 0.69 | MAOB (0.47) | CYP19A1CTSVCTSLLMNAALDH1A1 | |
| SCHEMBL26022674 | 0.69 | MAOB (0.47) | CYP19A1CTSVCTSLLMNAALDH1A1 | |
| SCHEMBL2893296 | 0.68 | GRIN2D (0.47) | CYP19A1CTSVCTSLMGMTMEN1 | |
| SCHEMBL31632401 | 0.68 | MAOB (0.47) | CYP19A1CTSVCTSLLMNAHPGD | |
| SCHEMBL28416297 | 0.68 | LMNA (0.47) | CYP19A1CTSVCTSLLMNAHPGD | |
| SCHEMBL16096563 | 0.66 | FEN1 (0.43) | FEN1RXRARXRBRXRGLMNA | |
| SCHEMBL12253970 | 0.66 | PTPN1 (0.47) | CYP19A1RXRARXRBRXRGCTSV |
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-1346982-B1 | VLA-4 INHIBITORS | DAIICHI SEIYAKU CO (JP) | 2011-09-14 | — | — | EP | disclosed |