Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 4/20 | 0.47 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.47 |
| ▸ | HTR2A | P28223 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 4/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | BCL9 | O00512 | 1/20 | 0.42 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | BCHE | P06276 | 1/20 | 0.42 |
| ▸ | ACHE | P22303 | 1/20 | 0.42 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL9629006 | 0.82 | KCNH2 (0.62) | KCNH2HTR2AMEN1KMT2ATDP1 | |
| SCHEMBL6377945 | 0.81 | HTR2A (0.49) | GAAHTR2AMAPTMEN1KMT2A | |
| SCHEMBL6377951 | 0.81 | HTR2A (0.49) | GAAHTR2AMAPTMEN1KMT2A | |
| SCHEMBL8213338 | 0.80 | HTR2A (0.48) | GAAHTR2AMAPTMEN1KMT2A | |
| SCHEMBL10434102 | 0.80 | MAPT (0.51) | GAAHTR2AMAPTMEN1KMT2A | |
| SCHEMBL10452742 | 0.79 | GAA (0.55) | GAAHTR2AMAPTMEN1KMT2A | |
| SCHEMBL4498261 | 0.78 | GAA (0.51) | GAAKCNH2HTR2AMAPTMEN1 | |
| SCHEMBL23647529 | 0.77 | IDO1 (0.49) | GAAHTR2AMAPTMEN1KMT2A | |
| SCHEMBL8515847 | 0.77 | HTR2A (0.46) | GAAHTR2AMAPTMEN1KMT2A | |
| SCHEMBL9320810 | 0.77 | MEN1 (0.54) | GAAHTR2AMAPTMEN1KMT2A |
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-1507530-A1 | DIAMINOTHIAZOLES | F. HOFFMANN-LA ROCHE AG (CH) | 2005-02-23 | — | — | EP | disclosed |
| WO-2003097048-A1 | DIAMINOTHIAZOLES | F. HOFFMANN-LA ROCHE AG (CH) | 2003-11-27 | — | — | WO | disclosed |