Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.60 |
| ▸ | KDM4E | B2RXH2 | 8/20 | 0.60 |
| ▸ | HPGD | P15428 | 6/20 | 0.60 |
| ▸ | GAA | P10253 | 2/20 | 0.60 |
| ▸ | POLB | P06746 | 2/20 | 0.60 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.60 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.60 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.60 |
| ▸ | MMP2 | P08253 | 1/20 | 0.49 |
| ▸ | MMP13 | P45452 | 1/20 | 0.49 |
| ▸ | MMP14 | P50281 | 1/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 5/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.47 |
| ▸ | MAPT | P10636 | 3/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL7017749 | 0.84 | CDC7 (0.46) | ALDH1A1KDM4EHPGDGAAPOLB | |
| SCHEMBL688481 | 0.83 | KDM4E (0.51) | ALDH1A1KDM4EHPGDGAAPOLB | |
| SCHEMBL4506134 | 0.82 | KDM4E (0.57) | ALDH1A1KDM4EHPGDGAAPOLB | |
| SCHEMBL18351089 | 0.82 | ALDH1A1 (0.57) | ALDH1A1KDM4EHPGDGAACYP1A2 | |
| SCHEMBL7016074 | 0.79 | MEN1 (0.47) | ALDH1A1KDM4EHPGDGAAPOLB | |
| SCHEMBL14875795 | 0.79 | ALDH1A1 (0.54) | ALDH1A1KDM4EHPGDGAACYP1A2 | |
| SCHEMBL12599782 | 0.78 | MAPT (0.53) | ALDH1A1KDM4EHPGDGAAPOLB | |
| SCHEMBL7007582 | 0.76 | ALDH1A1 (0.65) | ALDH1A1KDM4EHPGDGAAHSD17B10 | |
| SCHEMBL689137 | 0.76 | HPGD (1.00) | ALDH1A1KDM4EHPGDGAAPOLB | |
| SCHEMBL8203415 | 0.75 | ALDH1A1 (0.66) | ALDH1A1KDM4EHPGDGAAPOLB |
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 |
|---|---|---|---|---|---|---|---|
| EP-1329454-A1 | THIENOPYRIMIDINE COMPOUNDS AND THEIR SALTS AND PROCESS FOR PREPARATION OF BOTH | NIPPON SODA CO., LTD. (JP) | 2003-07-23 | — | — | EP | disclosed |