Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.43 |
| ▸ | ACHE | P22303 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | APP | P05067 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | STAT3 | P40763 | 1/20 | 0.41 |
| ▸ | EGFR | P00533 | 1/20 | 0.40 |
| ▸ | KDR | P35968 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL27675471 | 0.92 | KDM4E (0.43) | GAARXFP1KDM4EALDH1A1LMNA | |
| SCHEMBL27655435 | 0.91 | ACHE (0.42) | GAAACHEKDM4EALDH1A1APP | |
| SCHEMBL27655448 | 0.86 | ESR1 (0.43) | GAAACHEKDM4EMAPK1ALDH1A1 | |
| SCHEMBL27655438 | 0.85 | PDE5A (0.41) | KDM4EALDH1A1LMNAHPGDSMN1; SMN2 | |
| SCHEMBL27675431 | 0.85 | ACHE (0.48) | GAAACHEAPPEGFRKDR | |
| SCHEMBL27655527 | 0.84 | KDM4E (0.52) | GAARXFP1KDM4EALDH1A1LMNA | |
| SCHEMBL27675509 | 0.84 | GAA (0.48) | GAARXFP1KDM4EALDH1A1LMNA | |
| SCHEMBL7187840 | 0.82 | KDM4E (0.45) | GAARXFP1KDM4EALDH1A1LMNA | |
| SCHEMBL6708284 | 0.82 | KDM4E (0.49) | GAARXFP1KDM4EALDH1A1LMNA | |
| SCHEMBL27675572 | 0.82 | ACHE (0.47) | GAAACHEAPPLMNASMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-1875023-A | Use of thienopyrimidines | MERCK PATENT GMBH (DE) | 2006-12-06 | — | — | CN | disclosed |