Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | GRIN2C | Q14957 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.41 |
| ▸ | CHRNB1 | P11230 | 1/20 | 0.41 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.41 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.41 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.41 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.41 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.41 |
| ▸ | CHRNB3 | Q05901 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL3930902 | 0.89 | NPSR1 (0.48) | CHRNA1CHRNB1CHRNB2CHRNB4CHRNA3 | |
| SCHEMBL780353 | 0.88 | KDM4E (0.46) | ALDH1A1KDM4EGRIN2CCHRNA1CHRNB1 | |
| SCHEMBL778560 | 0.82 | CHRNA7 (0.57) | CHRNA7 | |
| SCHEMBL3930962 | 0.81 | ALDH1A1 (0.43) | ALDH1A1KMT2ACHRNA1CHRNB1CHRNB2 | |
| SCHEMBL15841933 | 0.81 | RECQL (0.47) | KMT2ACHRNA1CHRNB1CHRNB2CHRNB4 | |
| Hydrochloric Acid SCHEMBL780044 | 0.81 | KCNH2 (0.58) | — | |
| SCHEMBL4010198 | 0.80 | CHRNA1 (0.41) | CHRNA1CHRNB1CHRNB2CHRNB4CHRNA3 | |
| SCHEMBL3934162 | 0.79 | CHRNA7 (0.46) | CHRNA1CHRNB1CHRNB2CHRNB4CHRNA3 | |
| SCHEMBL3931014 | 0.78 | DRD2 (0.41) | CHRNA1CHRNB1CHRNB2CHRNB4CHRNA3 | |
| SCHEMBL3930577 | 0.78 | CHRNA1 (0.40) | CHRNA1CHRNB1CHRNB2CHRNB4CHRNA3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2044038-A2 | NOVEL PIPERAZINES, PHARMACEUTICAL COMPOSITIONS AND METHODS OF USE THEREOF | Cornerstone Therapeutics Inc. (US) | 2009-04-08 | — | — | EP | disclosed |
| WO-2007146066-A2 | NOVEL PIPERAZINES, PHARMACEUTICAL COMPOSITIONS AND METHODS OF USE THEREOF | CRITICAL THERAPEUTICS, INC. (US) | 2007-12-21 | — | — | WO | disclosed |