Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AMPD2 | Q01433 | 9/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | ELANE | P08246 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.42 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.42 |
| ▸ | GSK3A | P49840 | 1/20 | 0.41 |
| ▸ | GSK3B | P49841 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL3733166 | 0.76 | TSHR (0.52) | AMPD2ALDH1A1GAAELANELMNA | |
| SCHEMBL7264096 | 0.73 | HTR2C (0.47) | ALDH1A1GAADDB1CRBNMEN1 | |
| SCHEMBL6001297 | 0.73 | HTR2C (0.47) | ALDH1A1GAADDB1CRBNMEN1 | |
| SCHEMBL15571839 | 0.72 | ALDH1A1 (0.45) | AMPD2ALDH1A1GAAELANELMNA | |
| SCHEMBL2075062 | 0.72 | ALDH1A1 (0.45) | AMPD2ALDH1A1GAAELANELMNA | |
| SCHEMBL6049149 | 0.72 | ALDH1A1 (0.50) | AMPD2ALDH1A1GAAELANELMNA | |
| SCHEMBL13543074 | 0.70 | KMT2A (0.48) | ALDH1A1LMNADDB1CRBNGSK3A | |
| SCHEMBL14664096 | 0.69 | TSHR (0.48) | AMPD2ALDH1A1LMNAKMT2A | |
| SCHEMBL14828739 | 0.69 | TSHR (0.51) | AMPD2ALDH1A1GAALMNAKMT2A | |
| SCHEMBL2246388 | 0.68 | GAA (0.51) | AMPD2ALDH1A1GAAELANELMNA |
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-2427429-A1 | CARBOXAMIDE COMPOUNDS AND THEIR USE AS CALPAIN INHIBITORS | Abbott GmbH & Co. KG (DE) | 2012-03-14 | — | — | EP | disclosed |
| WO-2010128102-A1 | CARBOXAMIDE COMPOUNDS AND THEIR USE AS CALPAIN INHIBITORS | ABBOTT GMBH & CO. KG (DE) | 2010-11-11 | — | — | WO | disclosed |