Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 5/20 | 0.53 |
| ▸ | ESR2 | Q92731 | 5/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.52 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.52 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.47 |
| ▸ | HSD17B1 | P14061 | 3/20 | 0.47 |
| ▸ | HSD17B2 | P37059 | 3/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | BACE1 | P56817 | 1/20 | 0.46 |
| ▸ | PGR | P06401 | 1/20 | 0.44 |
| ▸ | HPRT1 | P00492 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | CDK4 | P11802 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL30703158 | 0.93 | ESR1 (0.58) | ESR1ESR2ALDH1A1HIF1ACYP1B1 | |
| SCHEMBL2724557 | 0.93 | ESR1 (0.58) | ESR1ESR2ALDH1A1HIF1ACYP1B1 | |
| SCHEMBL1987912 | 0.93 | ESR1 (0.58) | ESR1ESR2ALDH1A1HIF1ACYP1B1 | |
| SCHEMBL2723055 | 0.91 | ALDH1A1 (0.58) | ESR1ESR2ALDH1A1HIF1ACYP1B1 | |
| SCHEMBL19558296 | 0.91 | ESR1 (0.50) | ESR1ESR2ALDH1A1HIF1ACYP1B1 | |
| SCHEMBL3005121 | 0.91 | ESR1 (0.56) | ESR1ESR2ALDH1A1HIF1ACYP1B1 | |
| SCHEMBL30960425 | 0.91 | ESR1 (0.54) | ESR1ESR2ALDH1A1HIF1ACYP1B1 | |
| SCHEMBL3695546 | 0.91 | ESR1 (0.54) | ESR1ESR2ALDH1A1HIF1ACYP1B1 | |
| SCHEMBL6559203 | 0.88 | ALDH1A1 (0.61) | ESR1ESR2ALDH1A1HIF1ACYP1B1 | |
| SCHEMBL26478504 | 0.87 | ESR1 (0.44) | ESR1ESR2ALDH1A1HIF1ACYP1B1 |
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-107250150-B | Chlolic acid derivatives and preparation method thereof and medical usage | 江苏豪森药业集团有限公司 | 2019-11-22 | — | — | CN | disclosed |
| CN-107250150-A | Cholic acid derivative and preparation method and medical application thereof | 江苏豪森药业集团有限公司 | 2017-10-13 | — | — | CN | disclosed |