Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CKS1B | P61024 | 2/20 | 0.45 |
| ▸ | SKP1 | P63208 | 2/20 | 0.45 |
| ▸ | SKP2 | Q13309 | 2/20 | 0.45 |
| ▸ | DRD2 | P14416 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | MALT1 | Q9UDY8 | 1/20 | 0.41 |
| ▸ | IDO1 | P14902 | 1/20 | 0.41 |
| ▸ | PTGIR | P43119 | 2/20 | 0.40 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.40 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.40 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.40 |
| ▸ | AKT1 | P31749 | 1/20 | 0.40 |
| ▸ | BCHE | P06276 | 1/20 | 0.39 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL20140105 | 0.92 | CKS1B (0.44) | CKS1BSKP1SKP2DRD2SMN1; SMN2 | |
| SCHEMBL20140039 | 0.84 | CKS1B (0.44) | CKS1BSKP1SKP2DRD2SMN1; SMN2 | |
| SCHEMBL30239588 | 0.78 | CYP3A4 (0.47) | CKS1BSKP1SKP2DRD2IDO1 | |
| SCHEMBL1313637 | 0.77 | BRD9 (0.46) | CKS1BSKP1SKP2DRD2IDO1 | |
| SCHEMBL24931121 | 0.74 | ALDH1A1 (0.45) | SMN1; SMN2IDO1HDAC3HDAC1HDAC8 | |
| SCHEMBL28256776 | 0.73 | NQO2 (0.54) | CKS1BSKP1SKP2DRD2SMN1; SMN2 | |
| SCHEMBL17619511 | 0.73 | ALDH1A1 (0.56) | CKS1BSKP1SKP2DRD2SMN1; SMN2 | |
| SCHEMBL1949387 | 0.72 | CKS1B (0.47) | CKS1BSKP1SKP2DRD2IDO1 | |
| SCHEMBL20141217 | 0.72 | CKS1B (0.42) | CKS1BSKP1SKP2DRD2IDO1 | |
| SCHEMBL24376372 | 0.72 | BRD4 (0.48) | — |
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-2018089493-A1 | PYRROLE mTORC INHIBITORS AND USES THEREOF | NAVITOR PHARMACEUTICALS, INC. (US) | 2018-05-17 | — | — | WO | disclosed |