Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHFR | P00374 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | DHODH | Q02127 | 4/20 | 0.39 |
| ▸ | NAMPT | P43490 | 1/20 | 0.39 |
| ▸ | TYMS | P04818 | 1/20 | 0.37 |
| ▸ | BACE1 | P56817 | 1/20 | 0.37 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.37 |
| ▸ | CTSK | P43235 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.36 |
| ▸ | NTRK2 | Q16620 | 1/20 | 0.36 |
| ▸ | MAPK14 | Q16539 | 3/20 | 0.35 |
| ▸ | EGFR | P00533 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL10107977 | 0.89 | NPBWR1 (0.43) | DHFRKDM4EDHODHTYMSBACE1 | |
| SCHEMBL3383001 | 0.89 | DHODH (0.45) | DHFRKDM4EDHODHTYMSCTSK | |
| SCHEMBL10102652 | 0.88 | TRPA1 (0.43) | DHFRKDM4EDHODHNAMPTTYMS | |
| SCHEMBL13005264 | 0.86 | KDM4E (0.39) | DHFRKDM4EDHODHNAMPTTYMS | |
| SCHEMBL10102657 | 0.82 | NPBWR1 (0.44) | KDM4EDHODHBACE1TRPV1CTSK | |
| SCHEMBL10102644 | 0.82 | GPBAR1 (0.42) | KDM4EBACE1CTSKKCNH2 | |
| SCHEMBL10102653 | 0.81 | CTSK (0.40) | DHFRKDM4EDHODHNAMPTTYMS | |
| SCHEMBL10102671 | 0.81 | DHODH (0.46) | DHFRKDM4EDHODHTYMSBACE1 | |
| SCHEMBL10102646 | 0.79 | CTSK (0.47) | NAMPTCTSKKCNH2 | |
| SCHEMBL10107982 | 0.77 | KDM4E (0.36) | KDM4EDHODHBACE1CTSKKCNH2 |
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-1891011-B1 | TETRAHYDROQUINOLINES USED IN THE FORM OF MODULATORS OF MITOTIC MOTOR-PROTEINS EG5 | MERCK PATENT GMBH (DE) | 2010-12-08 | — | — | EP | disclosed |