Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | DNM1 | Q05193 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 3/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 5/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 3/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | FDPS | P14324 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL22756700 | 0.92 | OPRM1 (0.46) | DNM1TSHROPRM1CA1MAPT | |
| SCHEMBL12841152 | 0.86 | ALDH1A1 (0.37) | ALDH1A1TDP1DNM1TSHRCYP3A4 | |
| SCHEMBL21467732 | 0.84 | DNM1 (0.46) | DNM1TSHROPRM1CA2MAPT | |
| SCHEMBL23600870 | 0.82 | — | — | |
| SCHEMBL599090 | 0.82 | ALDH1A1 (0.42) | ALDH1A1TDP1DNM1TSHRCYP3A4 | |
| SCHEMBL23697601 | 0.82 | DNM1 (0.39) | ALDH1A1TDP1DNM1TSHRCYP3A4 | |
| SCHEMBL21765401 | 0.80 | ALDH1A1 (0.33) | ALDH1A1TDP1DNM1TSHRCYP3A4 | |
| SCHEMBL23893290 | 0.80 | — | — | |
| SCHEMBL16233631 | 0.80 | — | — | |
| SCHEMBL29017490 | 0.80 | — | — |
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-3698794-A1 | COMPOSITIONS AND METHODS FOR TREATING COLITIS | Aerpio Therapeutics, Inc. (US) | 2020-08-26 | — | — | EP | disclosed |
| EP-2562175-A1 | 5-FLUORO PYRIMIDINE DERIVATIVES AS FUNGICIDES | Dow AgroSciences LLC (US) | 2013-02-27 | — | — | EP | disclosed |