Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AHR | P35869 | 2/20 | 0.43 |
| ▸ | HTR1A | P08908 | 4/20 | 0.37 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.37 |
| ▸ | HTR1B | P28222 | 2/20 | 0.36 |
| ▸ | DRD4 | P21917 | 2/20 | 0.36 |
| ▸ | DRD3 | P35462 | 2/20 | 0.36 |
| ▸ | ADRB1 | P08588 | 3/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | ADRB2 | P07550 | 2/20 | 0.36 |
| ▸ | ADRB3 | P13945 | 2/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL28215201 | 0.83 | DHPS (0.36) | HTR1AHTR1BDRD4DRD3ADRB1 | |
| SCHEMBL30135671 | 0.73 | IDO1 (0.47) | DRD4DRD3 | |
| SCHEMBL403956 | 0.72 | IMPDH2 (0.57) | AHRPIK3CDADRB1MAPK1TRPA1 | |
| SCHEMBL18000260 | 0.72 | AHR (0.50) | AHRPIK3CDDRD4DRD3ADRB1 | |
| SCHEMBL97760 | 0.72 | AHR (0.50) | AHRPIK3CDDRD4DRD3ADRB1 | |
| SCHEMBL30309353 | 0.72 | IMPDH2 (0.57) | AHRPIK3CDADRB1MAPK1TRPA1 | |
| SCHEMBL31189980 | 0.72 | AHR (0.50) | AHRPIK3CDDRD4DRD3ADRB1 | |
| SCHEMBL27481040 | 0.71 | CHAT (0.49) | CYP1A2KDM4ECYP2D6TSHRMEN1 | |
| SCHEMBL1328989 | 0.69 | PRKCI (0.45) | AHRPIK3CD | |
| SCHEMBL38665028 | 0.68 | DAO (0.50) | AHRPIK3CDHTR1BCYP1A2CYP3A4 |
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-107973780-A | A kind of substituted alkenes compounds and its preparation method and application | 四川科伦博泰生物医药股份有限公司 | 2018-05-01 | — | — | CN | disclosed |