Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP13 | P45452 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | CTSS | P25774 | 3/20 | 0.32 |
| ▸ | CTSK | P43235 | 2/20 | 0.32 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.32 |
| ▸ | CTSL | P07711 | 1/20 | 0.32 |
| ▸ | CTSB | P07858 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL58396 | 0.87 | MMP13 (0.40) | MMP13CYP2C19HIF1AKDM4EPOLB | |
| SCHEMBL5981030 | 0.87 | MMP13 (0.40) | MMP13CYP2C19HIF1AKDM4EPOLB | |
| SCHEMBL88460 | 0.87 | MMP13 (0.40) | MMP13CYP2C19HIF1AKDM4EPOLB | |
| SCHEMBL5979942 | 0.86 | KMT2A (0.41) | MMP13CYP2C19HIF1AKDM4EPOLB | |
| SCHEMBL57636 | 0.83 | MMP13 (0.40) | MMP13CYP2C19HIF1AKMT2ANPSR1 | |
| SCHEMBL5980680 | 0.83 | MMP13 (0.38) | MMP13CYP2C19HIF1AKDM4EPOLB | |
| SCHEMBL88675 | 0.83 | MMP13 (0.40) | MMP13CYP2C19HIF1AKMT2ANPSR1 | |
| SCHEMBL4371988 | 0.76 | SMN1; SMN2 (0.49) | KMT2AALDH1A1RAB9ACTSSCTSL | |
| SCHEMBL20732299 | 0.76 | ESR1 (0.36) | MMP13KMT2ANPSR1ALDH1A1MEN1 | |
| SCHEMBL22069882 | 0.76 | ESR1 (0.36) | MMP13KMT2ANPSR1ALDH1A1MEN1 |
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-2968440-B1 | CYTOTOXIC AND ANTI-MITOTIC COMPOUNDS, AND METHODS OF USING THE SAME | ZYMEWORKS INC (CA) | 2019-06-05 | — | — | EP | disclosed |