Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.38 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.38 |
| ▸ | RELA | Q04206 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | CTSD | P07339 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.37 |
| ▸ | RECQL | P46063 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.36 |
| ▸ | TSHR | P16473 | 3/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.36 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.36 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | HTR2B | P41595 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL15945944 | 0.79 | ALDH1A1 (0.51) | ALDH1A1NFKB1NFKB2RELAHSD17B10 | |
| SCHEMBL6425179 | 0.77 | SMN1; SMN2 (0.47) | ALDH1A1SMN1; SMN2TRPA1LMNACYP1A2 | |
| SCHEMBL5175053 | 0.77 | KDM1A (0.36) | ALDH1A1NFKB1NFKB2RELASMN1; SMN2 | |
| SCHEMBL29127134 | 0.76 | ALDH1A1 (0.41) | ALDH1A1NFKB1NFKB2RELATDP1 | |
| SCHEMBL17980366 | 0.76 | FUCA1 (0.41) | ALDH1A1NFKB1NFKB2RELATDP1 | |
| SCHEMBL30887532 | 0.73 | ALDH1A1 (0.65) | ALDH1A1NFKB1NFKB2RELATDP1 | |
| SCHEMBL5175360 | 0.73 | SSTR4 (0.41) | ALDH1A1CYP3A4 | |
| SCHEMBL29127159 | 0.73 | KDM1A (0.53) | SMN1; SMN2SLC6A2 | |
| SCHEMBL3549036 | 0.73 | CNR2 (0.51) | HSD17B10SMN1; SMN2L3MBTL1 | |
| SCHEMBL7107008 | 0.73 | CNR2 (0.51) | HSD17B10SMN1; SMN2L3MBTL1 |
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-2005007614-A1 | MONOAMINE OXIDASE INHIBITORS | THE GOVERNMENT OF THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES 6011 (US) | 2005-01-27 | — | — | WO | disclosed |