Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CFTR | P13569 | 4/20 | 0.58 |
| ▸ | GAA | P10253 | 3/20 | 0.47 |
| ▸ | GLRA3 | O75311 | 1/20 | 0.44 |
| ▸ | GLRB | P48167 | 1/20 | 0.44 |
| ▸ | CYP46A1 | Q9Y6A2 | 1/20 | 0.41 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | GLA | P06280 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | TUBB4A | P04350 | 3/20 | 0.38 |
| ▸ | TUBB | P07437 | 3/20 | 0.38 |
| ▸ | TUBA3C | P0DPH7 | 3/20 | 0.38 |
| ▸ | TUBA1B | P68363 | 3/20 | 0.38 |
| ▸ | TUBA4A | P68366 | 3/20 | 0.38 |
| ▸ | TUBB4B | P68371 | 3/20 | 0.38 |
| ▸ | TUBB3 | Q13509 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL16463175 | 0.85 | CYP46A1 (0.58) | CFTRGLRA3GLRBCYP46A1ALDH1A1 | |
| SCHEMBL16114117 | 0.84 | CFTR (0.55) | CFTRGLRA3GLRBCYP46A1TUBB4A | |
| SCHEMBL29469507 | 0.84 | CFTR (0.52) | CFTRGAAGLRA3GLRBCYP46A1 | |
| SCHEMBL305696 | 0.80 | CFTR (0.53) | CFTRGLRA3GLRBALDH1A1KDM4E | |
| SCHEMBL8347921 | 0.80 | CFTR (0.48) | CFTRGLRA3GLRBCYP46A1ALDH1A1 | |
| SCHEMBL9705197 | 0.79 | GAA (0.65) | CFTRGAACYP46A1ABCB1ALDH1A1 | |
| SCHEMBL8347738 | 0.78 | CFTR (0.47) | CFTRGLRA3GLRBCYP46A1KDM4E | |
| SCHEMBL2726214 | 0.75 | CFTR (0.58) | CFTRGAAABCB1ALDH1A1KDM4E | |
| SCHEMBL29469477 | 0.75 | ALDH1A1 (0.51) | CFTRGAAGLRA3GLRBCYP46A1 | |
| SCHEMBL16197237 | 0.73 | GAA (0.47) | CFTRGAACYP46A1ABCB1ALDH1A1 |
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-2004000788-A1 | UREIDO-SUBSTITUTED ANILINE COMPOUNDS USEFUL AS SERINE PROTEASE INHIBITORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2003-12-31 | — | — | WO | disclosed |