Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 10/20 | 0.43 |
| ▸ | POLB | P06746 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 5/20 | 0.37 |
| ▸ | TSHR | P16473 | 3/20 | 0.37 |
| ▸ | CA2 | P00918 | 3/20 | 0.36 |
| ▸ | CA12 | O43570 | 2/20 | 0.36 |
| ▸ | CA1 | P00915 | 2/20 | 0.36 |
| ▸ | CA9 | Q16790 | 2/20 | 0.36 |
| ▸ | CA4 | P22748 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.34 |
| ▸ | CASP1 | P29466 | 1/20 | 0.34 |
| ▸ | RECQL | P46063 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL28797813 | 0.82 | ALDH1A1 (0.44) | ALDH1A1POLBMEN1KMT2ALMNA | |
| SCHEMBL8107118 | 0.81 | TSHR (0.43) | ALDH1A1POLBMEN1KMT2ALMNA | |
| SCHEMBL94021 | 0.79 | CYP3A4 (0.42) | ALDH1A1POLBMEN1KMT2ALMNA | |
| SCHEMBL29375628 | 0.79 | CYP3A4 (0.42) | ALDH1A1POLBMEN1KMT2ALMNA | |
| SCHEMBL147785 | 0.79 | ALDH1A1 (0.43) | ALDH1A1POLBMEN1KMT2ALMNA | |
| SCHEMBL11166279 | 0.76 | CHRNB2 (0.45) | ALDH1A1POLBMEN1KMT2ARECQL | |
| SCHEMBL3423630 | 0.75 | ALDH1A1 (0.52) | ALDH1A1LMNATDP1TSHRCA2 | |
| SCHEMBL28187809 | 0.74 | ALDH1A1 (0.50) | ALDH1A1LMNATDP1TSHRCA2 | |
| SCHEMBL3725884 | 0.73 | ALDH1A1 (0.49) | ALDH1A1MEN1KMT2AKDM4ETDP1 | |
| SCHEMBL27595402 | 0.72 | PBRM1 (0.36) | ALDH1A1TDP1TSHRCA2CA12 |
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-5015769-A | Hair dyes formed by reaction of an alcohol with a phenol in the presence of a strong base for etherification followed by amination | L'OREAL (FR) | 1991-05-14 | — | — | US | disclosed |