Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC40A1 | Q9NP59 | 1/20 | 0.55 |
| ▸ | ACLY | P53396 | 3/20 | 0.52 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.45 |
| ▸ | TCF4 | P15884 | 2/20 | 0.45 |
| ▸ | CTNNB1 | P35222 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | PIK3CA | P42336 | 3/20 | 0.44 |
| ▸ | MTOR | P42345 | 3/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | BRD4 | O60885 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.43 |
| ▸ | HSPD1 | P10809 | 1/20 | 0.43 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.43 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.43 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.43 |
| ▸ | HSPE1 | P61604 | 1/20 | 0.43 |
| ▸ | PLAU | P00749 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL13976075 | 0.92 | ACLY (0.53) | SLC40A1ACLYPIK3CGALDH1A1MEN1 | |
| SCHEMBL13976112 | 0.86 | SLC40A1 (0.58) | SLC40A1ACLYPIK3CGTCF4CTNNB1 | |
| SCHEMBL24139843 | 0.85 | SLC40A1 (0.57) | SLC40A1ACLYPIK3CGTCF4CTNNB1 | |
| SCHEMBL24139765 | 0.84 | SLC40A1 (0.56) | SLC40A1ACLYPIK3CGTCF4CTNNB1 | |
| SCHEMBL19558829 | 0.83 | ACLY (0.51) | SLC40A1ACLYPIK3CGALDH1A1MEN1 | |
| SCHEMBL13975453 | 0.83 | SLC40A1 (0.55) | SLC40A1ACLYPIK3CGTCF4CTNNB1 | |
| SCHEMBL24137238 | 0.83 | PIK3CG (0.45) | PIK3CGPIK3CAMTOR | |
| SCHEMBL24139986 | 0.82 | KDM4E (0.48) | SLC40A1ACLYALDH1A1MEN1KMT2A | |
| SCHEMBL24140017 | 0.82 | LMNA (0.51) | ALDH1A1MEN1KMT2APIK3CALMNA | |
| SCHEMBL24139918 | 0.79 | TSHR (0.48) | PIK3CGALDH1A1MEN1KMT2APIK3CA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2710018-B1 | MACROCYCLIC COMPOUNDS AS PROTEIN KINASE INHIBITORS | FUNDACION CENTRO NAC DE INVESTIGACIONES ONCOLOGICAS CARLOS III (ES) | 2021-12-29 | — | — | EP | disclosed |
| WO-2012156756-A2 | NEW COMPOUNDS | CENTRO NACIONAL DE INVESTIGACIONES ONCOLÓGICAS (CNIO) (ES) | 2012-11-22 | — | — | WO | disclosed |