Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.42 |
| ▸ | GSK3B | P49841 | 3/20 | 0.35 |
| ▸ | TP53 | P04637 | 3/20 | 0.34 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.34 |
| ▸ | HTR1A | P08908 | 2/20 | 0.34 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.34 |
| ▸ | DRD2 | P14416 | 2/20 | 0.34 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.34 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.34 |
| ▸ | DRD3 | P35462 | 2/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.34 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.34 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | HTR2C | P28335 | 1/20 | 0.34 |
| ▸ | HRH1 | P35367 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8315505 | 0.89 | HDAC6 (0.45) | HDAC6TP53CHRM2HTR1ACHRM1 | |
| SCHEMBL6745150 | 0.88 | HDAC6 (0.44) | HDAC6TP53CHRM2HTR1ACHRM1 | |
| SCHEMBL6747463 | 0.88 | HDAC6 (0.44) | HDAC6GSK3BCHRM2HTR1ACHRM1 | |
| SCHEMBL6747555 | 0.88 | HDAC6 (0.44) | HDAC6TP53HRH1MEN1KMT2A | |
| SCHEMBL6745834 | 0.87 | HDAC6 (0.43) | HDAC6TP53CHRM2HTR1ACHRM1 | |
| SCHEMBL6747320 | 0.85 | HDAC6 (0.57) | HDAC6TP53HDAC3HDAC1 | |
| SCHEMBL6746495 | 0.84 | HDAC6 (0.43) | HDAC6TP53CHRM2HTR1ACHRM1 | |
| SCHEMBL6751846 | 0.82 | HDAC6 (0.39) | HDAC6CYP1A2TSHRTHRBLMNA | |
| SCHEMBL6848543 | 0.81 | HDAC6 (0.43) | HDAC6TP53CHRM2HTR1ACHRM1 | |
| SCHEMBL6750196 | 0.81 | HDAC6 (0.44) | HDAC6MEN1KMT2ASMN1; SMN2THRB |
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 |
|---|---|---|---|---|---|---|---|
| US-6518423-B1 | These compounds are useful as drugs efficacious in the prevention and treatment of these various inflammatory diseases and immunologic diseases, such as rheumatoid arthritis, atopic dermatitis, psoriasis, asthma, and | EISAI CO., LTD. (JP) | 2003-02-11 | — | — | US | disclosed |
| EP-0934941-A1 | BENZOPIPERIDINE DERIVATIVES | Eisai Co., Ltd. (JP) | 1999-08-11 | — | — | EP | disclosed |