Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 2/20 | 0.44 |
| ▸ | MMP12 | P39900 | 1/20 | 0.44 |
| ▸ | CDK1 | P06493 | 1/20 | 0.43 |
| ▸ | PARP1 | P09874 | 1/20 | 0.42 |
| ▸ | QPCT | Q16769 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | PSMD11 | O00231 | 1/20 | 0.40 |
| ▸ | SCN4A | P35499 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | APEX1 | P27695 | 1/20 | 0.38 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
| ▸ | BLM | P54132 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL30467970 | 0.87 | MMP12 (0.60) | MMP12CDK1PARP1QPCTMAPT | |
| SCHEMBL23636201 | 0.87 | MMP12 (0.60) | MMP12CDK1PARP1QPCTMAPT | |
| SCHEMBL1799379 | 0.85 | QPCTL (0.45) | MMP12QPCTMAPTHTTSMN1; SMN2 | |
| SCHEMBL7013286 | 0.83 | PRKCI (0.51) | MMP12PARP1MAPTSMN1; SMN2KDM4E | |
| SCHEMBL16478923 | 0.83 | MMP12 (0.47) | MMP12PARP1QPCTMAPTHTT | |
| SCHEMBL4604506 | 0.82 | MMP12 (0.42) | MMP12CDK1QPCTMAPTKDM4E | |
| Hydrochloric Acid SCHEMBL1875585 | 0.82 | LTA4H (0.57) | QPCTKDM4EALDH1A1L3MBTL1 | |
| SCHEMBL903276 | 0.80 | PARP1 (0.52) | MMP12PARP1QPCTMAPTHTT | |
| SCHEMBL1875298 | 0.80 | P2RY14 (0.49) | MMP12QPCTMAPTKDM4EALDH1A1 | |
| SCHEMBL1876553 | 0.80 | P2RY14 (0.48) | MMP12MAPTPOLBSMN1; SMN2KDM4E |
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-2022086079-A1 | DERIVATIVE OF SEMICARBAZONE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF, AND USE THEREOF | 고려대학교 산학협력단 | 2022-04-28 | — | — | WO | disclosed |