Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.50 |
| ▸ | CA2 | P00918 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 3/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.47 |
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.47 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.47 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.47 |
| ▸ | MAOB | P27338 | 1/20 | 0.45 |
| ▸ | ACACB | O00763 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | GSK3B | P49841 | 1/20 | 0.44 |
| ▸ | BACE1 | P56817 | 1/20 | 0.44 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.42 |
| ▸ | SMPD1 | P17405 | 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 | |
|---|---|---|---|---|
| SCHEMBL17873425 | 1.00 | CA1 (0.50) | CA1CA2RAB9ASMN1; SMN2NPC1 | |
| SCHEMBL310921 | 1.00 | CA1 (0.50) | CA1CA2RAB9ASMN1; SMN2NPC1 | |
| SCHEMBL483661 | 0.89 | MAPT (0.50) | CA1CA2NR4A1NR4A2NR4A3 | |
| SCHEMBL13311119 | 0.89 | MAPT (0.50) | CA1CA2NR4A1NR4A2NR4A3 | |
| SCHEMBL20876895 | 0.88 | NR4A2 (0.51) | CA1CA2RAB9ANR4A1NR4A2 | |
| SCHEMBL2713179 | 0.88 | NR4A2 (0.51) | CA1CA2RAB9ANR4A1NR4A2 | |
| SCHEMBL2727830 | 0.88 | NR4A2 (0.51) | CA1CA2RAB9ANR4A1NR4A2 | |
| SCHEMBL483467 | 0.88 | JAK2 (0.46) | NR4A2MAOBSRD5A2SMPD1 | |
| SCHEMBL22534143 | 0.86 | KCNH2 (0.50) | CA1CA2RAB9ASMN1; SMN2NPC1 | |
| SCHEMBL22534142 | 0.86 | KCNH2 (0.50) | CA1CA2RAB9ASMN1; SMN2NPC1 |
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-1934176-B1 | QUATERNARY ALPHA-AMINOCARBOXAMIDE DERIVATIVES AS MODULATORS OF VOLTAGE-GATED SODIUM CHANNELS | GLAXO GROUP LTD (GB) | 2012-02-01 | — | — | EP | disclosed |