Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4B | Q07343 | 1/20 | 0.41 |
| ▸ | PIM1 | P11309 | 3/20 | 0.39 |
| ▸ | PIM2 | Q9P1W9 | 3/20 | 0.39 |
| ▸ | PARP1 | P09874 | 2/20 | 0.39 |
| ▸ | CDC7 | O00311 | 7/20 | 0.37 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.36 |
| ▸ | CDK2 | P24941 | 1/20 | 0.36 |
| ▸ | CDK9 | P50750 | 1/20 | 0.36 |
| ▸ | PLK1 | P53350 | 1/20 | 0.36 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.36 |
| ▸ | GRM5 | P41594 | 2/20 | 0.36 |
| ▸ | PARP10 | Q53GL7 | 2/20 | 0.36 |
| ▸ | PARP11 | Q9NR21 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | MAP4K1 | Q92918 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL31732376 | 1.00 | PDE4B (0.41) | PDE4BPIM1PIM2PARP1CDC7 | |
| SCHEMBL26660618 | 0.78 | POLB (0.43) | PIM1PIM2PARP1GRM5PARP10 | |
| SCHEMBL31501903 | 0.78 | POLB (0.43) | PIM1PIM2PARP1GRM5PARP10 | |
| SCHEMBL26660637 | 0.71 | MAP4K1 (0.45) | PARP1GRM5PARP10PARP11CYP1A2 | |
| SCHEMBL31501830 | 0.71 | MAP4K1 (0.45) | PARP1GRM5PARP10PARP11CYP1A2 | |
| SCHEMBL30669000 | 0.70 | PARP10 (0.47) | PARP1GRM5PARP10PARP11KDM4E | |
| SCHEMBL26671057 | 0.70 | PARP10 (0.47) | PARP1GRM5PARP10PARP11KDM4E | |
| SCHEMBL17111725 | 0.70 | PDE4B (0.46) | PDE4BPIM1PIM2PARP1CDC7 | |
| SCHEMBL23649631 | 0.68 | GRM5 (0.46) | PDE4BPIM1PIM2PARP1CDC7 | |
| SCHEMBL20302818 | 0.68 | PARP10 (0.41) | PIM1PIM2PARP1CDC7CDK2 |
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-2023230612-A1 | HETEROCYCLIC PAD4 INHIBITORS | CELGENE CORPORATION (US) | 2023-11-30 | — | — | WO | disclosed |