Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 3/20 | 0.53 |
| ▸ | BRD2 | P25440 | 1/20 | 0.50 |
| ▸ | BRD3 | Q15059 | 1/20 | 0.50 |
| ▸ | CASP2 | P42575 | 1/20 | 0.40 |
| ▸ | SRD5A1 | P18405 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | HSD17B3 | P37058 | 3/20 | 0.37 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.37 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.37 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.37 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.37 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.37 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.37 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.37 |
| ▸ | IDO1 | P14902 | 1/20 | 0.36 |
| ▸ | PIM1 | P11309 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | EGFR | P00533 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL29209001 | 1.00 | BRD4 (0.53) | BRD4BRD2BRD3CASP2SRD5A1 | |
| SCHEMBL22290464 | 0.86 | BRD4 (0.49) | BRD4BRD2BRD3CASP2SRD5A1 | |
| SCHEMBL31173196 | 0.86 | BRD4 (0.49) | BRD4BRD2BRD3CASP2SRD5A1 | |
| SCHEMBL10171016 | 0.81 | BRD4 (0.53) | BRD4CASP2SRD5A1MEN1KMT2A | |
| SCHEMBL5985150 | 0.81 | BRD4 (0.51) | BRD4BRD2BRD3SRD5A1HSD17B3 | |
| SCHEMBL8559372 | 0.79 | BRD4 (0.50) | BRD4BRD2BRD3SRD5A1GABRA1 | |
| SCHEMBL12081005 | 0.79 | BRD4 (0.50) | BRD4BRD2BRD3 | |
| SCHEMBL8141262 | 0.79 | BRD4 (0.50) | BRD4BRD2BRD3MEN1KMT2A | |
| SCHEMBL1771390 | 0.75 | ALDH1A1 (0.51) | BRD4MAPTLMNA | |
| SCHEMBL746154 | 0.75 | IDO1 (0.57) | BRD4CASP2SRD5A1MEN1KMT2A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2024222814-A1 | CYP11B2 INHIBITOR COMPOUND, PHARMACEUTICAL COMPOSITION AND USE THEREOF | 长春金赛药业有限责任公司 | 2024-10-31 | — | — | WO | disclosed |
| CN-117999259-A | Iron death modulators, their preparation and use | 维泰瑞隆有限公司 | 2024-05-07 | — | — | CN | disclosed |
| WO-2023280296-A1 | FERROPTOSIS MODULATORS, PREPARATIONS, AND USES THEREOF | Sironax Ltd. (KY) | 2023-01-12 | — | — | WO | disclosed |