Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCAT2 | O15382 | 2/20 | 0.56 |
| ▸ | BRD4 | O60885 | 1/20 | 0.50 |
| ▸ | IKBKB | O14920 | 8/20 | 0.46 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.45 |
| ▸ | CHUK | O15111 | 4/20 | 0.44 |
| ▸ | IKBKE | Q14164 | 1/20 | 0.44 |
| ▸ | PKMYT1 | Q99640 | 1/20 | 0.44 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.43 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.43 |
| ▸ | DHODH | Q02127 | 1/20 | 0.43 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.41 |
| ▸ | CASP1 | P29466 | 1/20 | 0.41 |
| ▸ | CDC7 | O00311 | 1/20 | 0.41 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.41 |
| ▸ | CDK2 | P24941 | 1/20 | 0.41 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.41 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.40 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.40 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.40 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL27721945 | 0.85 | PTPN1 (0.49) | PTGS1DHODHHDAC7 | |
| Ammonia Solution, Strong SCHEMBL27481370 | 0.84 | PTPN1 (0.47) | PTGS1DHODHHDAC7 | |
| SCHEMBL3898825 | 0.84 | BCAT2 (0.58) | BCAT2BRD4IKBKBCHUKIKBKE | |
| SCHEMBL18816717 | 0.82 | IKBKB (0.58) | BCAT2BRD4IKBKBPTGS1CHUK | |
| SCHEMBL27708585 | 0.80 | BCAT2 (0.50) | BCAT2BRD4IKBKBPTGS1CHUK | |
| SCHEMBL7311563 | 0.80 | BCAT2 (0.58) | BCAT2BRD4IKBKBCHUKIKBKE | |
| SCHEMBL9951887 | 0.79 | BCAT2 (0.53) | BCAT2BRD4IKBKBPTGS1CHUK | |
| SCHEMBL26056188 | 0.78 | DHODH (0.53) | BCAT2BRD4IKBKBPTGS1DHODH | |
| SCHEMBL29207452 | 0.77 | PTGS1 (0.41) | BCAT2PTGS1DHODHHDAC7GABRA1 | |
| SCHEMBL30034930 | 0.76 | BCAT2 (0.69) | BCAT2BRD4IKBKBSIRT2SIRT1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-2004502669-A | — | — | 2004-01-29 | — | — | JP | claimed |
| EP-1353898-A2 | COMPOUNDS TO TREAT ALZHEIMER'S DISEASE | Elan Pharmaceuticals, Inc. (US) | 2003-10-22 | — | — | EP | claimed |
| WO-2002002512-A2 | COMPOUNDS TO TREAT ALZHEIMER'S DISEASE | ELAN PHARMACEUTICALS, INC. (US) | 2002-01-10 | — | — | WO | claimed |