Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.47 |
| ▸ | CPT1B | Q92523 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 5/20 | 0.43 |
| ▸ | XBP1 | P17861 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | MPO | P05164 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 3/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | HSPA5 | P11021 | 1/20 | 0.36 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9733677 | 0.81 | CA1 (0.53) | ALDH1A1KDM4ETDP1GAAXBP1 | |
| SCHEMBL9734591 | 0.76 | ALDH1A1 (0.70) | ALDH1A1KDM4ETDP1GAAXBP1 | |
| SCHEMBL9733702 | 0.76 | HSPA5 (0.61) | ALDH1A1KDM4ETDP1GAAXBP1 | |
| SCHEMBL9734975 | 0.76 | ALDH1A1 (0.47) | ALDH1A1KDM4ETDP1GAAXBP1 | |
| SCHEMBL9736223 | 0.76 | ALDH1A1 (0.61) | ALDH1A1KDM4ETDP1GAAHTT | |
| SCHEMBL9733660 | 0.75 | ALDH1A1 (0.79) | ALDH1A1KDM4ETDP1GAAXBP1 | |
| SCHEMBL9734843 | 0.72 | ALDH1A1 (0.57) | ALDH1A1KDM4ETDP1GAAXBP1 | |
| SCHEMBL9849218 | 0.71 | ALDH1A1 (0.62) | ALDH1A1KDM4ETDP1GAAXBP1 | |
| SCHEMBL10104483 | 0.70 | ALDH1A1 (0.46) | ALDH1A1KDM4ETDP1CPT1BHTT | |
| SCHEMBL9734301 | 0.70 | ALDH1A1 (0.66) | ALDH1A1KDM4ETDP1GAAXBP1 |
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-5106975-A | Hexahydropyrimidine derivatives | ETHYL PETROLEUM ADDITIVES, INC. (US) | 1992-04-21 | — | — | US | disclosed |