Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 3/20 | 0.53 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.47 |
| ▸ | STS | P08842 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.43 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | CA12 | O43570 | 2/20 | 0.42 |
| ▸ | CA2 | P00918 | 2/20 | 0.42 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.42 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.41 |
| ▸ | CDK1 | P06493 | 1/20 | 0.41 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.41 |
| ▸ | GSK3A | P49840 | 1/20 | 0.41 |
| ▸ | GSK3B | P49841 | 1/20 | 0.41 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.41 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.41 |
| ▸ | CCNB3 | Q8WWL7 | 1/20 | 0.41 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL4667728 | 0.81 | STS (0.68) | CYP19A1ESR2STSFFAR1AKR1B1 | |
| SCHEMBL6800482 | 0.77 | LMNA (0.47) | CYP19A1STSALDH1A1HTTRAB9A | |
| SCHEMBL7046052 | 0.76 | CA2 (0.59) | ALDH1A1HTTRAB9ACA12CA2 | |
| SCHEMBL8120639 | 0.75 | CA2 (0.59) | CYP19A1STSALDH1A1RAB9ACA12 | |
| SCHEMBL6951995 | 0.75 | ESR2 (0.59) | ESR2ALDH1A1FFAR1AKR1B1RAB9A | |
| SCHEMBL1538262 | 0.72 | RAB9A (0.55) | ALDH1A1HTTRAB9ACA12CA2 | |
| SCHEMBL31410710 | 0.72 | ESR2 (0.76) | ESR2ALDH1A1FFAR1AKR1B1PTPN5 | |
| SCHEMBL17120715 | 0.72 | ESR2 (0.59) | ESR2ALDH1A1HTTRAB9APTPN5 | |
| SCHEMBL6960961 | 0.71 | ESR2 (0.54) | ESR2ALDH1A1FFAR1AKR1B1RAB9A | |
| SCHEMBL27291761 | 0.70 | RAB9A (0.53) | ALDH1A1HTTRAB9ACA12CA2 |
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 |
|---|---|---|---|---|---|---|---|
| US-6762205-B1 | STEROID SULFATASE INHIBITORS WITHOUT ESTROGENIC SIDE EFFECT ACTION | TEIKOKU HORMONE MFG. CO., LTD. (JP) | 2004-07-13 | — | — | US | disclosed |
| EP-1193250-A1 | PHENYL SULFAMATE DERIVATIVES | Teikoku Hormone Mfg. Co., Ltd. (JP) | 2002-04-03 | — | — | EP | disclosed |