Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 5/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 3/20 | 0.42 |
| ▸ | CA2 | P00918 | 2/20 | 0.42 |
| ▸ | MMP1 | P03956 | 1/20 | 0.42 |
| ▸ | MMP2 | P08253 | 1/20 | 0.42 |
| ▸ | MMP9 | P14780 | 1/20 | 0.42 |
| ▸ | MMP8 | P22894 | 1/20 | 0.42 |
| ▸ | MMP13 | P45452 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.36 |
| ▸ | NAMPT | P43490 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9612056 | 0.81 | ALDH1A1 (0.43) | HPGDALDH1A1CA1CA2MMP1 | |
| SCHEMBL2994450 | 0.79 | CA1 (0.61) | HPGDALDH1A1CA1CA2CA12 | |
| SCHEMBL6288936 | 0.79 | ALDH1A1 (0.46) | HPGDALDH1A1CA1LMNA | |
| SCHEMBL634317 | 0.78 | ALDH1A1 (0.66) | HPGDALDH1A1CA1CA2MMP1 | |
| SCHEMBL14039493 | 0.76 | ALDH1A1 (0.44) | HPGDALDH1A1CA1CA2SMN1; SMN2 | |
| SCHEMBL17029656 | 0.76 | HTT (0.42) | HPGDALDH1A1CA1CA2MMP1 | |
| SCHEMBL19708884 | 0.76 | CYP19A1 (0.50) | HPGDALDH1A1CA1CA2CA12 | |
| SCHEMBL14039773 | 0.74 | CNR2 (0.45) | HPGDALDH1A1LMNAHTTSMN1; SMN2 | |
| SCHEMBL2999740 | 0.73 | MAPT (0.57) | CA1CA2HTTCA12CA9 | |
| SCHEMBL17029652 | 0.71 | NPY5R (0.46) | HPGDALDH1A1CA1CA2MMP1 |
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-2137164-B1 | INHIBITORS OF PROTEIN KINASES | ASTRAZENECA AB (SE) | 2015-08-26 | — | — | EP | disclosed |