Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 8/20 | 0.46 |
| ▸ | TBXAS1 | P24557 | 6/20 | 0.43 |
| ▸ | QPCT | Q16769 | 1/20 | 0.37 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.36 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6953884 | 0.87 | ADRA2C (0.45) | TBXAS1QPCT | |
| SCHEMBL6955656 | 0.76 | TBXAS1 (0.56) | CYP19A1TBXAS1 | |
| SCHEMBL11635113 | 0.73 | CYP19A1 (0.55) | CYP19A1QPCTCYP11B1CYP11B2 | |
| SCHEMBL11633201 | 0.72 | CYP19A1 (0.73) | CYP19A1QPCTCYP11B1CYP11B2 | |
| SCHEMBL6955408 | 0.71 | CYP19A1 (0.47) | CYP19A1TBXAS1CYP11B1CYP11B2 | |
| SCHEMBL6955399 | 0.71 | CYP19A1 (0.47) | CYP19A1TBXAS1CYP11B1CYP11B2 | |
| SCHEMBL11392397 | 0.70 | CYP19A1 (0.48) | CYP19A1TBXAS1 | |
| SCHEMBL6963779 | 0.68 | SIRT2 (0.39) | — | |
| SCHEMBL12869982 | 0.67 | CYP17A1 (0.44) | — | |
| SCHEMBL11756428 | 0.67 | CYP19A1 (0.53) | CYP19A1QPCTCYP11B1CYP11B2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0974584-B1 | FUSED RING COMPOUNDS, PROCESS FOR PRODUCING THE SAME AND USE THEREOF | TAKEDA CHEMICAL INDUSTRIES LTD (JP) | 2003-01-15 | — | — | EP | disclosed |
| US-6420375-B1 | ANTITUMOR | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 2002-07-16 | — | — | US | disclosed |
| EP-0974584-A1 | FUSED RING COMPOUNDS, PROCESS FOR PRODUCING THE SAME AND USE THEREOF | Takeda Chemical Industries, Ltd. (JP) | 2000-01-26 | — | — | EP | disclosed |