Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 3/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.41 |
| ▸ | APEX1 | P27695 | 1/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | EIF4H | Q15056 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
| ▸ | PLK1 | P53350 | 1/20 | 0.40 |
| ▸ | BACE1 | P56817 | 1/20 | 0.40 |
| ▸ | SIRT1 | Q96EB6 | 2/20 | 0.38 |
| ▸ | ABCG2 | Q9UNQ0 | 3/20 | 0.38 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.38 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL28513252 | 0.91 | CYP19A1 (0.46) | CYP19A1MEN1POLBGAAMAPT | |
| SCHEMBL17503283 | 0.90 | NPC1 (0.45) | CYP19A1MEN1POLBGAAMAPT | |
| SCHEMBL17907267 | 0.89 | KMT2A (0.50) | CYP19A1MEN1POLBGAAMAPT | |
| SCHEMBL28879340 | 0.89 | ABCG2 (0.42) | CYP19A1MEN1POLBGAAMAPT | |
| SCHEMBL2124063 | 0.87 | TUBB4A (0.47) | CYP19A1MAPTNPC1RAB9AABCG2 | |
| SCHEMBL665266 | 0.83 | CYP19A1 (0.51) | CYP19A1MEN1POLBGAAMAPT | |
| SCHEMBL29204371 | 0.81 | CYP19A1 (0.42) | CYP19A1MEN1POLBGAAMAPT | |
| SCHEMBL17907271 | 0.81 | KMT2A (0.44) | CYP19A1MEN1POLBGAAMAPT | |
| SCHEMBL27950799 | 0.81 | TAS2R31 (0.39) | CYP19A1MEN1POLBMAPTKMT2A | |
| SCHEMBL10425234 | 0.79 | KDM4E (0.46) | NPC1RAB9ASIRT1ABCG2ABCB1 |
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 |
|---|---|---|---|---|---|---|---|
| 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 |