Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 2/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | TP53 | P04637 | 2/20 | 0.33 |
| ▸ | BRD4 | O60885 | 1/20 | 0.33 |
| ▸ | CCL2 | P13500 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | DRD2 | P14416 | 1/20 | 0.33 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.33 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.33 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 1/20 | 0.33 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.33 |
| ▸ | HRH1 | P35367 | 1/20 | 0.33 |
| ▸ | DRD3 | P35462 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9233000 | 0.82 | BRD4 (0.35) | HTR2ACYP2D6KDM4ETP53BRD4 | |
| SCHEMBL995535 | 0.81 | HTR2A (0.37) | HTR2ACYP2D6KDM4ETP53BRD4 | |
| Methane SCHEMBL5718665 | 0.78 | HTR2A (0.35) | HTR2ACYP2D6KDM4ETP53LMNA | |
| SCHEMBL15212735 | 0.78 | RET (0.33) | HTR2ACYP2D6CHRM2CHRM3RET | |
| SCHEMBL27734830 | 0.74 | HTR2A (0.34) | HTR2ACYP2D6ATM | |
| SCHEMBL28161717 | 0.73 | HTR2A (0.37) | HTR2ACYP2D6KDM4ETP53BRD4 | |
| SCHEMBL28725904 | 0.72 | BRD4 (0.36) | HTR2ACYP2D6KDM4ETP53BRD4 | |
| SCHEMBL22815155 | 0.72 | CYP2D6 (0.33) | HTR2ACYP2D6KDM4ETP53ALDH1A1 | |
| SCHEMBL4784825 | 0.72 | CYP2D6 (0.35) | HTR2ACYP2D6KDM4ETP53BRD4 | |
| SCHEMBL6604680 | 0.69 | BRD4 (0.35) | HTR2ACYP2D6BRD4CCL2NFKB1 |
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-106137862-B | Composition and cosmetics containing nano Chinese angelica | 南京谷润生物科技有限公司 | 2019-03-08 | — | — | CN | disclosed |
| CN-106137862-A | Composition containing nano Chinese angelica and cosmetics | 南京谷润生物科技有限公司 | 2016-11-23 | — | — | CN | disclosed |