Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADH1B | P00325 | 1/20 | 0.48 |
| ▸ | ADH1C | P00326 | 1/20 | 0.48 |
| ▸ | ADH1A | P07327 | 1/20 | 0.48 |
| ▸ | ADH7 | P40394 | 1/20 | 0.48 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.40 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.39 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | NR3C2 | P08235 | 2/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.36 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | TAAR1 | Q96RJ0 | 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 | |
|---|---|---|---|---|
| SCHEMBL6497592 | 0.79 | ADH1B (0.45) | ADH1BADH1CADH1AADH7ALDH1A1 | |
| SCHEMBL10818547 | 0.74 | ALDH1A1 (0.48) | ADH1BADH1CADH1AADH7MTNR1A | |
| SCHEMBL7230081 | 0.70 | ALDH1A1 (0.42) | KCNH2MTNR1AMTNR1BALDH1A1NR3C2 | |
| SCHEMBL12915440 | 0.68 | ALDH1A1 (0.46) | KCNH2MTNR1AMTNR1BALDH1A1NR3C2 | |
| SCHEMBL3278859 | 0.68 | TGM2 (0.48) | KCNH2MTNR1AMTNR1BALDH1A1HDAC1 | |
| SCHEMBL20057564 | 0.68 | ADH1B (0.42) | ADH1BADH1CADH1AADH7KCNH2 | |
| SCHEMBL10133724 | 0.66 | KMT2A (0.49) | ADH1BADH1CADH1AADH7ALDH1A1 | |
| SCHEMBL7357172 | 0.66 | MTNR1A (0.42) | KCNH2MTNR1AMTNR1BALDH1A1NR3C2 | |
| SCHEMBL1833672 | 0.65 | ALDH1A1 (0.42) | ADH1BADH1CADH1AADH7ALDH1A1 | |
| SCHEMBL27354 | 0.65 | ADH1B (1.00) | ADH1BADH1CADH1AADH7EPHX1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2005016883-A2 | ACRYLAMIDE DERIVATIVES AS VLA-1 INTEGRIN ANTAGONISTS AND USES THEREOF | ICOS CORPORATION (US) | 2005-02-24 | — | — | WO | claimed |
| WO-2005016883-A2 | ACRYLAMIDE DERIVATIVES AS VLA-1 INTEGRIN ANTAGONISTS AND USES THEREOF | ICOS CORPORATION (US) | 2005-02-24 | — | — | WO | disclosed |