Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HIF1A | Q16665 | 2/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | ESR1 | P03372 | 7/20 | 0.43 |
| ▸ | ESR2 | Q92731 | 7/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | MIF | P14174 | 3/20 | 0.38 |
| ▸ | HPGD | P15428 | 3/20 | 0.35 |
| ▸ | TSHR | P16473 | 3/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | TYR | P14679 | 1/20 | 0.35 |
| ▸ | AR | P10275 | 1/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.35 |
| ▸ | HTR6 | P50406 | 1/20 | 0.35 |
| ▸ | ESRRG | P62508 | 1/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL452064 | 0.76 | ESR2 (0.43) | HIF1AESR1ESR2CYP3A4ALDH1A1 | |
| SCHEMBL7608284 | 0.71 | BLM (0.50) | ESR1ESR2CYP3A4ALDH1A1HPGD | |
| SCHEMBL10743797 | 0.70 | ESR1 (0.35) | HIF1AESR1ESR2CYP3A4ALDH1A1 | |
| SCHEMBL5990790 | 0.70 | ESR1 (0.56) | HIF1ACYP2C19ESR1ESR2CYP3A4 | |
| SCHEMBL11510565 | 0.70 | ESR2 (0.56) | HIF1ACYP2C19ESR1ESR2CYP3A4 | |
| SCHEMBL4235812 | 0.70 | ESR1 (0.67) | HIF1ACYP2C19ESR1ESR2CYP3A4 | |
| SCHEMBL515846 | 0.69 | ESR1 (0.35) | HIF1AESR1ESR2CYP3A4ALDH1A1 | |
| SCHEMBL11756642 | 0.69 | ESR1 (0.55) | HIF1ACYP2C19ESR1ESR2CYP3A4 | |
| Bisphenol A SCHEMBL30080953 | 0.69 | ESR1 (0.44) | HIF1AESR1ESR2CYP3A4ALDH1A1 | |
| Glycidol SCHEMBL20637749 | 0.68 | ESR1 (0.50) | HIF1AESR1ESR2CYP3A4ALDH1A1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6395919-B1 | Calcilytic compounds | SMITHKLINE BEECHAM CORPORATION | 2002-05-28 | — | — | US | disclosed |
| EP-1070048-A4 | CALCILYTIC COMPOUNDS | SMITHKLINE BEECHAM CORP (US) | 2001-11-07 | — | — | EP | disclosed |
| EP-1070048-A1 | CALCILYTIC COMPOUNDS | SMITHKLINE BEECHAM CORPORATION (US) | 2001-01-24 | — | — | EP | disclosed |
| WO-1999051569-A1 | CALCILYTIC COMPOUNDS | SMITHKLINE BEECHAM CORPORATION (US) | 1999-10-14 | — | — | WO | disclosed |