Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 6/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | MPO | P05164 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9734301 | 0.86 | ALDH1A1 (0.66) | ALDH1A1KDM4ETDP1MAPTHSD17B10 | |
| SCHEMBL9734467 | 0.85 | ALDH1A1 (0.68) | ALDH1A1KDM4ETDP1MAPTHSD17B10 | |
| SCHEMBL9733752 | 0.82 | ALDH1A1 (0.68) | ALDH1A1KDM4ETDP1MAPTHSD17B10 | |
| SCHEMBL9733713 | 0.82 | ALDH1A1 (0.49) | ALDH1A1KDM4ETDP1MAPTHSD17B10 | |
| SCHEMBL9734929 | 0.81 | KDM4E (0.51) | ALDH1A1KDM4ETDP1MAPTGAA | |
| SCHEMBL9416940 | 0.80 | ALDH1A1 (0.64) | ALDH1A1KDM4ETDP1MAPTHSD17B10 | |
| SCHEMBL9746354 | 0.79 | ALDH1A1 (0.51) | ALDH1A1KDM4ETDP1MAPTHSD17B10 | |
| SCHEMBL9849461 | 0.78 | ALDH1A1 (0.54) | ALDH1A1KDM4ETDP1MAPTHSD17B10 | |
| SCHEMBL25435385 | 0.77 | ALDH1A1 (0.59) | ALDH1A1KDM4ETDP1MAPTHSD17B10 | |
| SCHEMBL9733660 | 0.77 | ALDH1A1 (0.79) | ALDH1A1KDM4ETDP1MAPTHSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| US-5106975-A | Hexahydropyrimidine derivatives | ETHYL PETROLEUM ADDITIVES, INC. (US) | 1992-04-21 | — | — | US | disclosed |
| EP-0434185-A2 | Hexahydropyrimidine derivatives | ETHYL PETROLEUM ADDITIVES, INC. (US) | 1991-06-26 | — | — | EP | disclosed |