Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.33 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.33 |
| ▸ | ELANE | P08246 | 1/20 | 0.33 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.32 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | ATM | Q13315 | 2/20 | 0.32 |
| ▸ | KLK7 | P49862 | 1/20 | 0.32 |
| ▸ | UCHL1 | P09936 | 2/20 | 0.32 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL26464083 | 0.82 | CYP1A2 (0.47) | CYP1A2POLBCYP3A4CYP2C19CHRM2 | |
| SCHEMBL26464450 | 0.82 | CYP1A2 (0.47) | CYP1A2POLBCYP3A4CYP2C19CHRM2 | |
| SCHEMBL26464715 | 0.82 | CYP1A2 (0.47) | CYP1A2POLBCYP3A4CYP2C19CHRM2 | |
| SCHEMBL26464816 | 0.82 | CYP1A2 (0.47) | CYP1A2POLBCYP3A4CYP2C19CHRM2 | |
| SCHEMBL26464539 | 0.82 | CYP1A2 (0.47) | CYP1A2POLBCYP3A4CYP2C19CHRM2 | |
| SCHEMBL9893215 | 0.81 | HSD17B10 (0.50) | EPHX2HSD17B10KDM4EKLK7UCHL1 | |
| SCHEMBL4959104 | 0.81 | HSD17B10 (0.50) | EPHX2HSD17B10KDM4EKLK7UCHL1 | |
| SCHEMBL357242 | 0.81 | HSD17B10 (0.50) | EPHX2HSD17B10KDM4EKLK7UCHL1 | |
| SCHEMBL3055656 | 0.80 | MMP2 (0.48) | CYP1A2POLBCYP3A4CYP2C19CHRM2 | |
| SCHEMBL22655184 | 0.80 | MMP2 (0.48) | CYP1A2POLBCYP3A4CYP2C19CHRM2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3050883-A1 | PRODUCTION METHOD FOR DIAZABICYCLOOCTANE DERIVATIVE AND INTERMEDIARY BODY THEREOF | Meiji Seika Pharma Co., Ltd. (JP) | 2016-08-03 | — | — | EP | disclosed |