Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 2/20 | 0.44 |
| ▸ | BRD4 | O60885 | 1/20 | 0.40 |
| ▸ | CCL2 | P13500 | 1/20 | 0.40 |
| ▸ | HTR6 | P50406 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 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 |
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 | |
|---|---|---|---|---|
| SCHEMBL24061842 | 0.78 | BRD4 (0.49) | HTR2ABRD4CCL2ATMKDM4E | |
| SCHEMBL28310354 | 0.69 | ALDH1A1 (0.39) | HTR2ABRD4CCL2ATMLMNA | |
| SCHEMBL28374476 | 0.69 | BRD4 (0.41) | HTR2ABRD4CCL2ATMKDM4E | |
| SCHEMBL28323510 | 0.68 | PRCP (0.35) | HTR2ABRD4CCL2ATMDRD2 | |
| SCHEMBL7551620 | 0.65 | BRD4 (0.49) | HTR2ABRD4CCL2HTR6ATM | |
| SCHEMBL16872444 | 0.65 | CNR2 (0.41) | HTR2ABRD4CCL2CYP2D6KCNH2 | |
| SCHEMBL31046607 | 0.64 | HTR2A (0.43) | HTR2ABRD4CCL2HTR6KDM4E | |
| SCHEMBL6233907 | 0.64 | HTR2A (0.43) | HTR2ABRD4CCL2HTR6KDM4E | |
| SCHEMBL10694747 | 0.63 | BRD4 (0.55) | HTR2ABRD4CCL2ATMKDM4E | |
| SCHEMBL8256345 | 0.63 | HTR2A (0.69) | HTR2ABRD4CCL2HTR6KDM4E |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114685532-A | Macrocyclic compound and medical application thereof | 正大天晴药业集团股份有限公司 | 2022-07-01 | — | — | CN | disclosed |