Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CRBN | Q96SW2 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 3/20 | 0.37 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | MPO | P05164 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | MC4R | P32245 | 1/20 | 0.37 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.37 |
| ▸ | MC3R | P41968 | 1/20 | 0.37 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.37 |
| ▸ | CA9 | Q16790 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | MAOA | P21397 | 1/20 | 0.37 |
| ▸ | MAOB | P27338 | 1/20 | 0.37 |
| ▸ | THPO | P40225 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| Pyridine SCHEMBL8567227 | 0.86 | NAPRT (0.47) | CRBNTSHRADORA3CYP1A2CYP3A4 | |
| Pyrazine SCHEMBL27913358 | 0.81 | CYP1A2 (0.62) | TSHRADORA3CYP1A2CYP3A4KDM4E | |
| Pyrazine SCHEMBL28327835 | 0.79 | ALDH1A1 (0.50) | TSHRADORA3CYP1A2CYP3A4KDM4E | |
| SCHEMBL15045 | 0.79 | — | — | |
| SCHEMBL27939070 | 0.79 | CRBN (0.60) | CRBNTSHRCYP1A2CYP3A4KDM4E | |
| SCHEMBL27524722 | 0.79 | CRBN (0.60) | CRBNTSHRCYP1A2CYP3A4KDM4E | |
| SCHEMBL27560286 | 0.79 | CRBN (0.60) | CRBNTSHRCYP1A2CYP3A4KDM4E | |
| Pyrazine SCHEMBL4712089 | 0.76 | ACHE (0.54) | TSHRADORA3CYP1A2CYP3A4KDM4E | |
| Pyrazine SCHEMBL306074 | 0.76 | ACHE (0.54) | TSHRADORA3CYP1A2CYP3A4KDM4E | |
| Benzene SCHEMBL27729594 | 0.76 | CRBN (0.50) | CRBNTSHRCYP1A2CYP3A4CYP2C19 |
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-0229391-B1 | PIPERIDINE DERIVATE, ITS USE AND PHARMACEUTICAL COMPOSITION CONTAINING IT | Eisai Co., Ltd. (JP) | 1992-07-29 | — | — | EP | claimed |
| CN-110317321-A | Quinoid conjugated polymer and preparation method and application thereof | 东莞理工学院 | 2019-10-11 | — | — | CN | disclosed |