Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR17 | Q13304 | 4/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | HTR1A | P08908 | 1/20 | 0.40 |
| ▸ | FBP1 | P09467 | 4/20 | 0.39 |
| ▸ | GRIA2 | P42262 | 1/20 | 0.39 |
| ▸ | MPO | P05164 | 1/20 | 0.38 |
| ▸ | NQO2 | P16083 | 1/20 | 0.38 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.38 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | CDK2 | P24941 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL18509231 | 0.85 | GPR17 (0.50) | GPR17HPGDCYP2C19FBP1GRIA2 | |
| SCHEMBL18498538 | 0.85 | GPR17 (0.50) | GPR17HPGDCYP2C19FBP1GRIA2 | |
| SCHEMBL18509630 | 0.85 | GPR17 (0.67) | GPR17HPGDCYP2C19FBP1GRIA2 | |
| SCHEMBL31675726 | 0.81 | GPR17 (0.47) | GPR17HPGDCYP2C19FBP1GRIA2 | |
| SCHEMBL18509504 | 0.81 | GPR17 (0.46) | GPR17HPGDCYP2C19FBP1GRIA2 | |
| SCHEMBL18000164 | 0.79 | PTPRA (0.55) | HPGDCYP2C19HTR1AGRIA2MPO | |
| SCHEMBL18029200 | 0.79 | PTPRA (0.55) | HPGDCYP2C19HTR1AGRIA2MPO | |
| SCHEMBL19872691 | 0.79 | KDM4E (0.45) | CYP2C19HTR1AFBP1NQO2MTNR1A | |
| SCHEMBL18000267 | 0.79 | PTPRA (0.55) | HPGDCYP2C19HTR1AGRIA2MPO | |
| SCHEMBL18498511 | 0.79 | GPR17 (0.44) | GPR17HPGDCYP2C19FBP1GRIA2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2016134145-A9 | ARTIFICIAL SELF-SUFFICIENT CYTOCHROME P450S | UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) | 2017-02-16 | — | — | WO | disclosed |