Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 2/20 | 0.64 |
| ▸ | HPGD | P15428 | 3/20 | 0.59 |
| ▸ | CA1 | P00915 | 1/20 | 0.56 |
| ▸ | CA2 | P00918 | 1/20 | 0.56 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | ERCC1 | P07992 | 1/20 | 0.52 |
| ▸ | ERCC4 | Q92889 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.52 |
| ▸ | NPC1 | O15118 | 2/20 | 0.51 |
| ▸ | RAB9A | P51151 | 2/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL8441394 | 0.83 | KMT2A (0.58) | HTTKMT2AMEN1ERCC1ERCC4 | |
| SCHEMBL27893497 | 0.81 | CA12 (0.54) | HTTHPGDCA1CA2NPSR1 | |
| Hydrochloric Acid SCHEMBL5768744 | 0.79 | KMT2A (0.54) | HTTCA1CA2KMT2AMEN1 | |
| SCHEMBL12980401 | 0.77 | NAAA (0.60) | HTTHPGDCA2NPSR1ALDH1A1 | |
| SCHEMBL10038330 | 0.77 | NAAA (0.60) | HTTHPGDCA2NPSR1ALDH1A1 | |
| SCHEMBL7634201 | 0.77 | NPSR1 (0.53) | HTTHPGDNPSR1ALDH1A1 | |
| SCHEMBL2036620 | 0.77 | HPGD (0.73) | HPGDCA1CA2KMT2AMEN1 | |
| SCHEMBL11155982 | 0.77 | KMT2A (0.58) | HTTKMT2AMEN1ERCC1ERCC4 | |
| SCHEMBL10998260 | 0.77 | GLS (0.55) | HTTKMT2AMEN1ERCC1ERCC4 | |
| SCHEMBL11268059 | 0.77 | HTT (0.66) | HTTKMT2AMEN1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010043377-A1 | NEW 2-AMIDOTHIADIAZOLE DERIVATIVES | ALMIRALL, S.A. (ES) | 2010-04-22 | — | — | WO | disclosed |