Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.46 |
| ▸ | AURKA | O14965 | 1/20 | 0.44 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.44 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.44 |
| ▸ | PARP1 | P09874 | 3/20 | 0.44 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.42 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.42 |
| ▸ | MPO | P05164 | 1/20 | 0.41 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL4977141 | 0.88 | KDM4E (0.49) | KDM4EALDH1A1HPGDHSD17B10MAPK8 | |
| SCHEMBL10604934 | 0.83 | PLA2G2A (0.49) | ADRA1DSIRT2 | |
| SCHEMBL8943463 | 0.81 | ABCB11 (0.45) | KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL11003395 | 0.79 | TAAR1 (0.48) | ALDH1A1MPOTAAR1 | |
| SCHEMBL28412131 | 0.78 | TSHR (0.50) | KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL2628166 | 0.77 | TSHR (0.57) | KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL5718302 | 0.76 | CYP17A1 (0.46) | RPS6KB1PARP1PARP2 | |
| SCHEMBL3622854 | 0.76 | PARP1 (0.47) | KDM4EALDH1A1HPGDHSD17B10PARP1 | |
| SCHEMBL658650 | 0.75 | KDM4E (0.53) | KDM4EALDH1A1HPGDHSD17B10 | |
| Ammonia Solution, Strong SCHEMBL17727872 | 0.74 | PARP1 (0.46) | KDM4EALDH1A1HPGDHSD17B10PARP1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5516777-A | PROSTATE CANCER THERAPY | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1996-05-14 | — | — | US | disclosed |
| EP-0594149-A2 | Condensed pyrazole derivatives, method of manufacturing the same, and androgen inhibitor | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1994-04-27 | — | — | EP | disclosed |