Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | CASP6 | P55212 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.31 |
| ▸ | BRD4 | O60885 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | SMYD3 | Q9H7B4 | 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 | |
|---|---|---|---|---|
| SCHEMBL25560105 | 0.82 | DEGS1 (0.38) | ALDH1A1SMN1; SMN2EPHX1L3MBTL1CASP6 | |
| SCHEMBL25464262 | 0.78 | — | — | |
| SCHEMBL11911967 | 0.78 | — | — | |
| SCHEMBL25464261 | 0.78 | — | — | |
| SCHEMBL3229891 | 0.72 | EPHX2 (0.51) | EPHX1EPHX2BRD4POLBSMYD3 | |
| SCHEMBL3229882 | 0.72 | EPHX2 (0.51) | EPHX1EPHX2BRD4POLBSMYD3 | |
| SCHEMBL3539009 | 0.72 | EPHX2 (0.51) | EPHX1EPHX2BRD4POLBSMYD3 | |
| SCHEMBL16247773 | 0.72 | SMN1; SMN2 (0.36) | ALDH1A1SMN1; SMN2 | |
| SCHEMBL16247733 | 0.72 | MAPT (0.45) | ALDH1A1PKMKMT2AMEN1 | |
| SCHEMBL19509263 | 0.72 | DRD2 (0.37) | ALDH1A1SMN1; SMN2EPHX1L3MBTL1PKM |
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-9139534-B2 | Substituted diaminocarboxamide and diaminocarbonitrile pyrimidines, compositions thereof, and methods of treatment therewith | SIGNAL PHARMACEUTICALS, LLC (US) | 2015-09-22 | — | — | US | disclosed |