Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 1/20 | 0.42 |
| ▸ | AR | P10275 | 1/20 | 0.42 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.41 |
| ▸ | MAPT | P10636 | 5/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 2/20 | 0.38 |
| ▸ | CA9 | Q16790 | 2/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9641066 | 0.84 | CYP2C9 (0.36) | ARALDH1A1MAPTKDM4EHPGD | |
| SCHEMBL9641143 | 0.84 | CYP19A1 (0.33) | CYP19A1KLK7MAOB | |
| SCHEMBL9641115 | 0.84 | PBRM1 (0.38) | ARTDP1CYP19A1KLK7 | |
| SCHEMBL9641582 | 0.82 | TTR (0.38) | ALDH1A1MAPTHPGDTDP1MAPK1 | |
| SCHEMBL9641097 | 0.79 | ALDH1A1 (0.44) | ABCB1ARABCG2ALDH1A1MAPT | |
| SCHEMBL16334358 | 0.71 | MAOB (0.51) | ALDH1A1KDM4ESMN1; SMN2CA12CA9 | |
| SCHEMBL25316752 | 0.70 | L3MBTL1 (0.42) | SMN1; SMN2CA9CA2 | |
| SCHEMBL8377614 | 0.68 | NPC1 (0.53) | ABCB1ARABCG2ALDH1A1MAPT | |
| SCHEMBL5369640 | 0.68 | MAOA (0.56) | ALDH1A1MAPTKDM4EGAAHPGD | |
| SCHEMBL648702 | 0.67 | BCAT2 (0.40) | GAACA12CA9CA2 |
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 |
|---|---|---|---|---|---|---|---|
| US-5106407-A | Algicides, funcilides, bactericides | THE DOW CHEMICAL COMPANY (US) | 1992-04-21 | — | — | US | disclosed |