Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 1/20 | 0.52 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.52 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.52 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.52 |
| ▸ | BRD4 | O60885 | 4/20 | 0.46 |
| ▸ | ATAD2 | Q6PL18 | 4/20 | 0.46 |
| ▸ | PRKCZ | Q05513 | 1/20 | 0.44 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.43 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.41 |
| ▸ | MAP4K1 | Q92918 | 1/20 | 0.40 |
| ▸ | PRKCI | P41743 | 2/20 | 0.39 |
| ▸ | PIM1 | P11309 | 4/20 | 0.39 |
| ▸ | PIM2 | Q9P1W9 | 4/20 | 0.39 |
| ▸ | CCNT1 | O60563 | 2/20 | 0.39 |
| ▸ | CCNK | O75909 | 2/20 | 0.39 |
| ▸ | CCNE1 | P24864 | 2/20 | 0.39 |
| ▸ | CDK2 | P24941 | 2/20 | 0.39 |
| ▸ | CDK9 | P50750 | 2/20 | 0.39 |
| ▸ | CDK12 | Q9NYV4 | 2/20 | 0.39 |
| ▸ | CDK7 | P50613 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL23360479 | 0.99 | HTR1A (0.51) | HTR1AADRA1DADRA1AADRA1BBRD4 | |
| Hydrochloric Acid SCHEMBL23360476 | 0.99 | HTR1A (0.51) | HTR1AADRA1DADRA1AADRA1BBRD4 | |
| Hydrochloric Acid SCHEMBL23360276 | 0.91 | HTR1A (0.54) | HTR1AADRA1DADRA1AADRA1BBRD4 | |
| SCHEMBL29862367 | 0.90 | BRD4 (0.43) | HTR1AADRA1DADRA1AADRA1BBRD4 | |
| SCHEMBL29862976 | 0.90 | BRD4 (0.43) | HTR1AADRA1DADRA1AADRA1BBRD4 | |
| Hydrochloric Acid SCHEMBL23360570 | 0.89 | BRD4 (0.42) | HTR1AADRA1DADRA1AADRA1BBRD4 | |
| Hydrochloric Acid SCHEMBL23360411 | 0.89 | BRD4 (0.42) | HTR1AADRA1DADRA1AADRA1BBRD4 | |
| Hydrochloric Acid SCHEMBL23360408 | 0.89 | BRD4 (0.42) | HTR1AADRA1DADRA1AADRA1BBRD4 | |
| SCHEMBL29862532 | 0.84 | HTR1A (0.55) | HTR1AADRA1DADRA1AADRA1BPRKCZ | |
| Hydrochloric Acid SCHEMBL23360240 | 0.84 | SMN1; SMN2 (0.44) | PRKCZRPS6KB1PIK3CAPRKCIPIM1 |
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-114867719-A | Pyrrolidine and piperidine compounds | 柳韩洋行 | 2022-08-05 | — | — | CN | disclosed |