Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | BRD4 | O60885 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 4/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.40 |
| ▸ | THRB | P10828 | 2/20 | 0.40 |
| ▸ | JAK2 | O60674 | 1/20 | 0.40 |
| ▸ | JAK1 | P23458 | 1/20 | 0.40 |
| ▸ | TYK2 | P29597 | 1/20 | 0.40 |
| ▸ | JAK3 | P52333 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | GPR119 | Q8TDV5 | 2/20 | 0.39 |
| ▸ | BCHE | P06276 | 1/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6644118 | 0.87 | KDM4E (0.46) | KDM4EALDH1A1BRD4POLBCREBBP | |
| SCHEMBL4767736 | 0.80 | OPRM1 (0.52) | KDM4EALDH1A1BRD4POLBCREBBP | |
| SCHEMBL7629914 | 0.76 | OPRM1 (0.48) | KDM4EALDH1A1BRD4POLBCREBBP | |
| SCHEMBL29212348 | 0.76 | JAK2 (0.42) | KDM4EALDH1A1BRD4POLBCREBBP | |
| SCHEMBL31270465 | 0.76 | JAK2 (0.42) | KDM4EALDH1A1BRD4POLBCREBBP | |
| SCHEMBL557776 | 0.76 | KDM4E (0.70) | KDM4EALDH1A1BRD4POLBCREBBP | |
| Hydrochloric Acid SCHEMBL1703924 | 0.75 | KDM4E (0.68) | KDM4EALDH1A1BRD4POLBCREBBP | |
| SCHEMBL19297229 | 0.73 | GPR119 (0.47) | KDM4EALDH1A1MAPTSMN1; SMN2THRB | |
| SCHEMBL19284729 | 0.73 | GPR119 (0.47) | KDM4EMAPTSMN1; SMN2THRBGAA | |
| SCHEMBL31386163 | 0.73 | KDM4E (0.44) | KDM4EALDH1A1BRD4POLBCREBBP |
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-1487822-A2 | PYRROLE-2,5-DIONE DERIVATIVES AND THEIR USE AS GSK-3 INHIBITORS | ELI LILLY AND COMPANY (US) | 2004-12-22 | — | — | EP | disclosed |
| WO-2003076398-A2 | PYRROLE-2, 5-DIONE DERIVATIVES AND THEIR USE AS GSK-3 INHIBITORS | ELI LILLY AND COMPANY (US) | 2003-09-18 | — | — | WO | disclosed |