Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | GRM5 | P41594 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | KEAP1 | Q14145 | 2/20 | 0.41 |
| ▸ | NFE2L2 | Q16236 | 2/20 | 0.41 |
| ▸ | MAOB | P27338 | 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 | |
|---|---|---|---|---|
| SCHEMBL20418657 | 0.81 | RAB9A (0.43) | ALDH1A1MAPTHPGDHTTL3MBTL1 | |
| SCHEMBL29447544 | 0.81 | RAB9A (0.43) | ALDH1A1MAPTHPGDHTTL3MBTL1 | |
| SCHEMBL20418653 | 0.80 | ALDH1A1 (0.44) | ALDH1A1TDP1CYP3A4TSHRMAPK1 | |
| SCHEMBL20401096 | 0.79 | TSPO (0.40) | ALDH1A1MAPTHPGDHTTTDP1 | |
| SCHEMBL19667309 | 0.78 | HTT (0.48) | ALDH1A1HTTTDP1CYP3A4TSHR | |
| SCHEMBL20418711 | 0.78 | HTT (0.36) | ALDH1A1HTTTDP1TSHRKEAP1 | |
| SCHEMBL29447580 | 0.78 | HTT (0.36) | ALDH1A1HTTTDP1TSHRKEAP1 | |
| SCHEMBL29447455 | 0.77 | KEAP1 (0.37) | ALDH1A1HTTKEAP1NFE2L2 | |
| SCHEMBL8677521 | 0.77 | MTNR1B (0.44) | ALDH1A1MAPTHPGDGRM5TDP1 | |
| SCHEMBL20418487 | 0.76 | HTR2C (0.46) | ALDH1A1MAPTHPGDHTTTDP1 |
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-2018136935-A1 | 2-ARYLSULFONAMIDO-N-ARYLACETAMIDE DERIVATIZED STAT3 INHIBITORS | UNIVERSITY OF HAWAII (US) | 2018-07-26 | — | — | WO | disclosed |