Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 1/20 | 0.46 |
| ▸ | BRD4 | O60885 | 1/20 | 0.43 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.43 |
| ▸ | EGFR | P00533 | 4/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | ALOX5 | P09917 | 3/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | SRC | P12931 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL5672450 | 0.82 | PARP1 (0.60) | PARP1BRD4CREBBPALDH1A1HPGD | |
| SCHEMBL7982283 | 0.72 | EGFR (0.54) | EGFRALDH1A1HPGDHSD17B10MAPK1 | |
| SCHEMBL7984452 | 0.70 | PARP1 (0.45) | PARP1BRD4CREBBPEGFRALDH1A1 | |
| SCHEMBL29495518 | 0.70 | PARP1 (0.57) | PARP1BRD4CREBBPALDH1A1HPGD | |
| SCHEMBL1398633 | 0.70 | PARP1 (0.57) | PARP1BRD4CREBBPALDH1A1HPGD | |
| SCHEMBL7982133 | 0.70 | PARP1 (0.45) | PARP1BRD4CREBBPEGFRALDH1A1 | |
| SCHEMBL5670843 | 0.70 | PARP1 (0.45) | PARP1BRD4CREBBPALDH1A1HPGD | |
| SCHEMBL20703758 | 0.69 | PARP1 (0.55) | PARP1BRD4CREBBPALDH1A1HPGD | |
| SCHEMBL5673003 | 0.68 | PARP1 (0.42) | PARP1BRD4CREBBPEGFRALDH1A1 | |
| SCHEMBL5672408 | 0.68 | ALDH1A1 (0.40) | PARP1BRD4CREBBPEGFRALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6191127-B1 | ANTIINFLAMMATORY AGENTS, AUTOIMMUNE DISEASES, CARDIOVASCULAR DISORDERS, NERVOUS SYSTEM DISORDERS | SCHERING AKTIENGESELLSCHAFT (DE) | 2001-02-20 | — | — | US | disclosed |