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| { | |
| "board": "BRD4", | |
| "target": "CHEMBL1163125", | |
| "type": "IC50", | |
| "cut": 2022, | |
| "threshold": 6.5, | |
| "n_train": 5595, | |
| "n_test": 2402, | |
| "positive_rate": 0.3859283930058285, | |
| "noise_floor": { | |
| "pairs": 8948, | |
| "compounds": 627, | |
| "median": 0.2814396191743418, | |
| "mean": 0.44751677771143744, | |
| "p75": 0.615224460689137, | |
| "p90": 1.0280217133101441, | |
| "sd_single": 0.3967347320136857 | |
| }, | |
| "baselines": { | |
| "์์ ์์ธก": { | |
| "auroc": 0.5, | |
| "prauc": 0.3859283930058285, | |
| "mae": 1.0784183108137753 | |
| }, | |
| "์ต๊ทผ์ ์ด์": { | |
| "auroc": 0.6795341268535279, | |
| "prauc": 0.5062603292552335, | |
| "mae": 1.0292439819281891 | |
| }, | |
| "Morgan+LightGBM": { | |
| "auroc": 0.8614308960927359, | |
| "prauc": 0.7769106527745347, | |
| "mae": 0.8549645558861177 | |
| } | |
| }, | |
| "near_threshold": 694, | |
| "split_grade": "T", | |
| "split_grade_note": "์ต์ด ๋ณด๊ณ ์ฐ๋ ๊ธฐ์ค ์๊ฐ ๋ถํ ", | |
| "answer_grade": "P1", | |
| "answer_grade_note": "์ ๋ต์ด ChEMBL ์ ๊ณต๊ฐ๋์ด ์๋ค. ์กฐํ ๋ฐฉ์ด๋ 8์กฐ๊ฐ ๋งก๋๋ค", | |
| "source": "ChEMBL_37", | |
| "built": "2026-08-23" | |
| } |