Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.40 |
| ▸ | MAPT | P10636 | 4/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 7/20 | 0.40 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.40 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.40 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.40 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.38 |
| ▸ | HPGD | P15428 | 5/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.38 |
| ▸ | POLB | P06746 | 4/20 | 0.38 |
| ▸ | MEN1 | O00255 | 3/20 | 0.38 |
| ▸ | CASP1 | P29466 | 3/20 | 0.38 |
| ▸ | CASP7 | P55210 | 3/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.38 |
| ▸ | PKM | P14618 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL27850030 | 0.76 | MAP2K1 (0.48) | ALDH1A1HSD17B10MAPK1KDM4EHPGD | |
| SCHEMBL4834567 | 0.74 | HCAR2 (0.45) | ALDH1A1MAPTADORA3KDM4EHPGD | |
| SCHEMBL4834558 | 0.74 | HCAR2 (0.45) | ALDH1A1MAPTADORA3KDM4EHPGD | |
| SCHEMBL4831166 | 0.74 | ERN1 (0.41) | ALDH1A1MAPTHSD17B10ADORA3ADORA2A | |
| SCHEMBL15750805 | 0.71 | KDM4E (0.45) | ALDH1A1HSD17B10MAPK1KDM4EHPGD | |
| SCHEMBL11602553 | 0.71 | ALDH1A1 (0.43) | ALDH1A1MAPTHSD17B10ADORA3ADORA2A | |
| SCHEMBL11608122 | 0.71 | CHEK1 (0.46) | ALDH1A1MAPTCYP1A2KDM4EPOLB | |
| SCHEMBL5204576 | 0.69 | TSHR (0.44) | ALDH1A1MAPTCYP1A2KDM4ETDP1 | |
| SCHEMBL4763433 | 0.69 | KDM4E (0.36) | ALDH1A1MAPTHSD17B10MAPK1CYP1A2 | |
| SCHEMBL30436844 | 0.68 | NR4A2 (0.49) | ALDH1A1ADORA3ADORA2AADORA2BADORA1 |
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-4093812-A | MICROBIOCIDES, DISINFECTANTS | BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DT) | 1978-06-06 | — | — | US | disclosed |