Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 4/20 | 0.49 |
| ▸ | MAOB | P27338 | 3/20 | 0.49 |
| ▸ | ABCG2 | Q9UNQ0 | 3/20 | 0.46 |
| ▸ | AR | P10275 | 3/20 | 0.46 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.46 |
| ▸ | STS | P08842 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | MAOA | P21397 | 1/20 | 0.43 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.42 |
| ▸ | SLC8A1 | P32418 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL23320530 | 1.00 | CYP19A1 (0.49) | CYP19A1MAOBABCG2ARABCB1 | |
| SCHEMBL23320569 | 0.85 | LMNA (0.54) | CYP19A1MAOBABCG2ARABCB1 | |
| SCHEMBL29232536 | 0.76 | ALDH1A1 (0.57) | ALDH1A1KDM4ECYP1A2 | |
| SCHEMBL30943262 | 0.75 | MAOB (0.46) | CYP19A1MAOBABCG2ARABCB1 | |
| SCHEMBL4159662 | 0.73 | MAOB (0.73) | CYP19A1MAOBABCG2ARABCB1 | |
| SCHEMBL7604102 | 0.72 | MAOB (0.67) | CYP19A1MAOBABCG2ARABCB1 | |
| SCHEMBL32498549 | 0.70 | MAOB (0.65) | CYP19A1MAOBARALDH1A1KDM4E | |
| SCHEMBL403523 | 0.70 | MAOB (0.65) | CYP19A1MAOBARALDH1A1KDM4E | |
| SCHEMBL11290060 | 0.70 | MAOB (0.65) | CYP19A1MAOBCYP3A4MAOAPSMB5 | |
| SCHEMBL27387867 | 0.69 | HIF1A (0.41) | CYP19A1MAOBALDH1A1KDM4EMEN1 |
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-112654608-B | Fused ring compound having urea structure | 桑福德伯纳姆普利斯医学发现研究所 | 2024-05-07 | — | — | CN | disclosed |
| CN-112654608-A | Condensed ring compounds having urea structure | 桑福德伯纳姆普利斯医学发现研究所 | 2021-04-13 | — | — | CN | disclosed |