Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 2/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | HPGD | P15428 | 3/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | CHEK2 | O96017 | 5/20 | 0.42 |
| ▸ | GLA | P06280 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 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 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.40 |
| ▸ | PIN1 | Q13526 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | CASP1 | P29466 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL10694134 | 0.86 | PARP1 (0.50) | PARP1KDM4EALDH1A1HPGDKMT2A | |
| SCHEMBL10695587 | 0.84 | CHEK2 (0.48) | PARP1KDM4EALDH1A1HPGDKMT2A | |
| SCHEMBL10694623 | 0.84 | PARP1 (0.51) | PARP1KMT2ACHEK2MEN1 | |
| SCHEMBL10695465 | 0.84 | PARP1 (0.43) | PARP1CHEK2MMP2MMP9MMP8 | |
| SCHEMBL10695803 | 0.84 | CHEK2 (0.47) | PARP1KDM4EALDH1A1KMT2ACHEK2 | |
| Hydrochloric Acid SCHEMBL10695451 | 0.84 | PARP1 (0.49) | PARP1KDM4EALDH1A1HPGDKMT2A | |
| SCHEMBL3559177 | 0.82 | CHEK2 (0.57) | CHEK2 | |
| SCHEMBL10695311 | 0.81 | KDM4E (0.48) | PARP1KDM4EALDH1A1HPGDKMT2A | |
| SCHEMBL10695184 | 0.81 | PARP1 (0.54) | PARP1KDM4ECHEK2CSNK2A1PIN1 | |
| SCHEMBL10694101 | 0.81 | PARP1 (0.54) | PARP1CHEK2 |
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-0269238-A1 | Imidazoles and their compositions for plant growth regulation | MAY & BAKER LIMITED (GB) | 1988-06-01 | — | — | EP | disclosed |