Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 2/20 | 0.78 |
| ▸ | MEN1 | O00255 | 2/20 | 0.69 |
| ▸ | MAPT | P10636 | 2/20 | 0.69 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.69 |
| ▸ | POLB | P06746 | 2/20 | 0.69 |
| ▸ | GAA | P10253 | 1/20 | 0.69 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.69 |
| ▸ | APEX1 | P27695 | 1/20 | 0.69 |
| ▸ | RECQL | P46063 | 1/20 | 0.69 |
| ▸ | EIF4H | Q15056 | 1/20 | 0.69 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.69 |
| ▸ | NPC1 | O15118 | 1/20 | 0.64 |
| ▸ | RAB9A | P51151 | 1/20 | 0.64 |
| ▸ | ABCG2 | Q9UNQ0 | 5/20 | 0.63 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.63 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.57 |
| ▸ | HPGD | P15428 | 2/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL28513250 | 0.92 | MEN1 (0.74) | CYP19A1MEN1MAPTKMT2APOLB | |
| SCHEMBL28879338 | 0.90 | ABCG2 (0.77) | CYP19A1MEN1MAPTKMT2APOLB | |
| SCHEMBL9063227 | 0.90 | CYP19A1 (0.70) | CYP19A1MEN1MAPTKMT2APOLB | |
| SCHEMBL17907266 | 0.89 | MEN1 (0.86) | CYP19A1MEN1MAPTKMT2APOLB | |
| SCHEMBL2124058 | 0.87 | CYP19A1 (0.68) | CYP19A1MEN1MAPTKMT2APOLB | |
| SCHEMBL4439740 | 0.85 | CYP19A1 (0.74) | CYP19A1MEN1MAPTKMT2APOLB | |
| SCHEMBL665265 | 0.84 | CYP19A1 (0.84) | CYP19A1MEN1MAPTKMT2APOLB | |
| SCHEMBL28336829 | 0.84 | MEN1 (0.58) | CYP19A1MEN1MAPTKMT2APOLB | |
| SCHEMBL17907269 | 0.84 | MEN1 (0.67) | CYP19A1MEN1MAPTKMT2APOLB | |
| SCHEMBL29204369 | 0.82 | NPC1 (0.67) | CYP19A1MEN1MAPTKMT2APOLB |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114636764-B | Screening method of anti-inflammatory and antiviral active ingredients of andrographis paniculata | 中国科学院武汉植物园 | 2024-01-26 | — | — | CN | disclosed |
| CN-115068491-A | Medical application of andrographolide as LTB4 receptor inhibitor | 中国医学科学院药物研究所 | 2022-09-20 | — | — | CN | disclosed |
| CN-115068467-A | Medical application of andrographolide as LTB4 receptor inhibitor | 中国医学科学院药物研究所 | 2022-09-20 | — | — | CN | disclosed |
| CN-114636764-A | Method for screening anti-inflammatory and antiviral active ingredients of andrographis paniculata | 中国科学院武汉植物园 | 2022-06-17 | — | — | CN | disclosed |
| CN-105311335-A | Traditional Chinese medicine composition for assisting tumor chemoradiotherapy | LU ZHONGXIN | 2016-02-10 | — | — | CN | disclosed |