Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 3/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.32 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | GLA | P06280 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | CASP1 | P29466 | 1/20 | 0.32 |
| ▸ | CASP7 | P55210 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 3/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL4357522 | 0.88 | POLB (0.33) | POLBSMN1; SMN2HIF1ATP53CYP2C9 | |
| SCHEMBL6567254 | 0.82 | — | — | |
| SCHEMBL4346954 | 0.75 | KMT2A (0.40) | POLBSMN1; SMN2HIF1ATP53CYP2C9 | |
| SCHEMBL4357518 | 0.70 | POLB (0.47) | POLBSMN1; SMN2HIF1ATP53CYP2C9 | |
| SCHEMBL4345693 | 0.69 | POLB (0.37) | POLBSMN1; SMN2TP53KDM4EALDH1A1 | |
| SCHEMBL4358520 | 0.69 | AKR1C4 (0.36) | POLBSMN1; SMN2HIF1ATP53KDM4E | |
| SCHEMBL6565448 | 0.69 | EPHX2 (0.41) | ALDH1A1GAAHTTMEN1MAPT | |
| SCHEMBL6568620 | 0.68 | CA1 (0.36) | POLBHIF1ACYP2C9KDM4EALDH1A1 | |
| SCHEMBL4352959 | 0.67 | POLB (0.40) | POLBSMN1; SMN2TP53KDM4EALDH1A1 | |
| SCHEMBL6566803 | 0.66 | POLB (0.57) | POLBSMN1; SMN2CYP2C9CYP2C19KDM4E |
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-1402887-A1 | New compounds for the inhibition of undesired cell proliferation and use thereof | Jerini AG (DE) | 2004-03-31 | — | — | EP | claimed |
| EP-1402888-A1 | The use of substituted carbocyclic compounds as rotamases inhibitors | Jerini AG (DE) | 2004-03-31 | — | — | EP | claimed |