Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.44 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | EPHX1 | P07099 | 2/20 | 0.38 |
| ▸ | SLC6A1 | P30531 | 3/20 | 0.35 |
| ▸ | SLC6A11 | P48066 | 3/20 | 0.35 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.35 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.35 |
| ▸ | SLC6A12 | P48065 | 2/20 | 0.35 |
| ▸ | SLC6A13 | Q9NSD5 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.35 |
| ▸ | GABRR1 | P24046 | 1/20 | 0.35 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.35 |
| ▸ | SSTR1 | P30872 | 1/20 | 0.35 |
| ▸ | SSTR4 | P31391 | 1/20 | 0.35 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.34 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.34 |
| ▸ | CDK4 | P11802 | 1/20 | 0.33 |
| ▸ | CDK2 | P24941 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL6632233 | 1.00 | HRH4 (0.44) | HRH4HRH3KCNH2EPHX1SLC6A1 | |
| Trifluoroacetic Acid SCHEMBL6632301 | 1.00 | HRH4 (0.44) | HRH4HRH3KCNH2EPHX1SLC6A1 | |
| Trifluoroacetic Acid SCHEMBL27731525 | 0.89 | EPHX1 (0.45) | HRH4HRH3EPHX1GABRA5GABRB2 | |
| Trifluoroacetic Acid SCHEMBL4037193 | 0.85 | HRH4 (0.34) | HRH4HRH3 | |
| Trifluoroacetic Acid SCHEMBL14829310 | 0.85 | HRH4 (0.34) | HRH4HRH3 | |
| Trifluoroacetic Acid SCHEMBL3296189 | 0.83 | HRH4 (0.34) | HRH4HRH3 | |
| Trifluoroacetic Acid SCHEMBL34474246 | 0.83 | HRH4 (0.46) | HRH4HRH3KCNH2EPHX1SLC6A1 | |
| Trifluoroacetic Acid SCHEMBL13738933 | 0.81 | KCNH2 (0.68) | HRH4HRH3KCNH2EPHX1SLC6A1 | |
| Trifluoroacetic Acid SCHEMBL3327970 | 0.81 | HRH4 (0.42) | HRH4HRH3KCNH2EPHX1SLC6A1 | |
| Trifluoroacetic Acid SCHEMBL13739305 | 0.81 | KCNH2 (0.68) | HRH4HRH3KCNH2EPHX1SLC6A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1438046-A4 | THIAZOLE BENZAMIDE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS FOR INHIBITING CELL PROLIFERATION, AND METHODS FOR THEIR USE | AGOURON PHARMA (US) | 2004-10-20 | — | — | EP | disclosed |
| EP-1438046-A2 | THIAZOLE BENZAMIDE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS FOR INHIBITING CELL PROLIFERATION, AND METHODS FOR THEIR USE | AGOURON PHARMACEUTICALS, INC. (US) | 2004-07-21 | — | — | EP | disclosed |
| WO-2003004467-A2 | THIAZOLE BENZAMIDE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS FOR INHIBITING CELL PROLIFERATION, AND METHODS FOR THEIR USE | AGOURON PHARMACEUTICALS, INC. (US) | 2003-01-16 | — | — | WO | disclosed |