Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | NAAA | Q02083 | 2/20 | 0.40 |
| ▸ | CCR2 | P41597 | 4/20 | 0.40 |
| ▸ | BTK | Q06187 | 1/20 | 0.39 |
| ▸ | CTSD | P07339 | 4/20 | 0.38 |
| ▸ | BACE1 | P56817 | 3/20 | 0.38 |
| ▸ | F2 | P00734 | 1/20 | 0.38 |
| ▸ | F10 | P00742 | 1/20 | 0.38 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.38 |
| ▸ | CCR1 | P32246 | 1/20 | 0.37 |
| ▸ | CCR5 | P51681 | 1/20 | 0.37 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.37 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.37 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.37 |
| ▸ | RELA | Q04206 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8837786 | 1.00 | GAA (0.47) | GAAALDH1A1KMT2ANAAACCR2 | |
| SCHEMBL22482721 | 0.90 | GAA (0.49) | GAAKMT2ANAAACCR2BTK | |
| SCHEMBL29675327 | 0.80 | GAA (0.52) | GAAKMT2ACCR2BTKCTSD | |
| SCHEMBL8837689 | 0.80 | GAA (0.52) | GAAKMT2ACCR2BTKCTSD | |
| SCHEMBL8837707 | 0.80 | GAA (0.52) | GAAKMT2ACCR2BTKCTSD | |
| SCHEMBL8837694 | 0.80 | GAA (0.52) | GAAKMT2ACCR2BTKCTSD | |
| SCHEMBL22482787 | 0.80 | GAA (0.52) | GAAKMT2ACCR2BTKCTSD | |
| SCHEMBL22482790 | 0.80 | GAA (0.52) | GAAKMT2ACCR2BTKCTSD | |
| SCHEMBL7396988 | 0.80 | GAA (0.49) | GAANAAACCR2BTKBACE1 | |
| SCHEMBL23282460 | 0.74 | GAA (0.55) | GAACCR2BTKCTSDBACE1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5654294-A | CARDIOVASCULAR DISORDERS | BRISTOL-MYERS SQUIBB (US) | 1997-08-05 | — | — | US | disclosed |
| US-5646276-A | ANGIOTENSIN CONVERTING ENZYME AND NEUTRAL ENDOPEPTIDASE INHIBITORS; CARDIOVASCULAR DISORDERS | BRISTOL-MYERS SQUIBB CO. (US) | 1997-07-08 | — | — | US | disclosed |
| US-5552397-A | HYPOTENSIVE AGENTS | E. R. SQUIBB & SONS, INC. (US) | 1996-09-03 | — | — | US | disclosed |