Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.48 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.47 |
| ▸ | MAOB | P27338 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | SIRT1 | Q96EB6 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | MMP2 | P08253 | 2/20 | 0.43 |
| ▸ | MMP9 | P14780 | 1/20 | 0.43 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.43 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.43 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.43 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.43 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.43 |
| ▸ | MMP13 | P45452 | 2/20 | 0.43 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.43 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.43 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL2835599 | 1.00 | TP53 (0.48) | TP53KCNH2MAOBKDM4ESIRT1 | |
| SCHEMBL2832438 | 0.91 | KCNH2 (0.51) | TP53KCNH2MAOBKDM4ESIRT1 | |
| SCHEMBL2831540 | 0.91 | KCNH2 (0.51) | TP53KCNH2MAOBKDM4ESIRT1 | |
| SCHEMBL483518 | 0.87 | YAP1 (0.45) | TP53KCNH2MAOBKDM4EMMP2 | |
| Ethane SCHEMBL483694 | 0.87 | YAP1 (0.45) | TP53KCNH2MAOBKDM4EMMP2 | |
| SCHEMBL483557 | 0.87 | YAP1 (0.45) | TP53KCNH2MAOBKDM4EMMP2 | |
| SCHEMBL483558 | 0.87 | YAP1 (0.45) | TP53KCNH2MAOBKDM4EMMP2 | |
| SCHEMBL484203 | 0.87 | YAP1 (0.45) | TP53KCNH2MAOBKDM4EMMP2 | |
| SCHEMBL4830206 | 0.82 | HTR1A (0.46) | TP53SIRT1ALDH1A1 | |
| SCHEMBL841357 | 0.80 | KCNH2 (0.48) | TP53KCNH2MAOBKDM4EALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1934176-A1 | QUATERNARY ALPHA-AMINOCARBOXAMIDE DERIVATIVES AS MODULATORS OF VOLTAGE-GATED SODIUM CHANNELS | GLAXO GROUP LIMITED (GB) | 2008-06-25 | — | — | EP | disclosed |
| WO-2007042240-A1 | QUATERNARY ALPHA-AMINOCARBOXAMIDE DERIVATIVES AS MODULATORS OF VOLTAGE-GATED SODIUM CHANNELS | GLAXO GROUP LIMITED (GB) | 2007-04-19 | — | — | WO | disclosed |