Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.43 |
| ▸ | ACHE | P22303 | 3/20 | 0.43 |
| ▸ | APP | P05067 | 3/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | TNF | P01375 | 1/20 | 0.41 |
| ▸ | NOD1 | Q9Y239 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.41 |
| ▸ | EGFR | P00533 | 1/20 | 0.40 |
| ▸ | KDR | P35968 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 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 | |
|---|---|---|---|---|
| SCHEMBL27675558 | 0.92 | ESR1 (0.46) | ESR1 | |
| SCHEMBL27675451 | 0.86 | GAA (0.43) | ACHEAPPSMN1; SMN2LMNAKDM4E | |
| SCHEMBL27655435 | 0.84 | ACHE (0.42) | ACHEAPPSMN1; SMN2LMNAKDM4E | |
| SCHEMBL27655593 | 0.84 | ESR1 (0.49) | ESR1SMN1; SMN2LMNAKDM4EMAPK1 | |
| SCHEMBL27675427 | 0.84 | ESR1 (0.48) | ESR1LMNAALDH1A1MEN1KMT2A | |
| SCHEMBL27675431 | 0.83 | ACHE (0.48) | ACHEAPPTNFNOD1EGFR | |
| SCHEMBL27675452 | 0.82 | PDE4A (0.48) | ESR1LMNAKDM4EEGFRALDH1A1 | |
| SCHEMBL27675572 | 0.80 | ACHE (0.47) | ACHEAPPSMN1; SMN2LMNATNF | |
| SCHEMBL27655444 | 0.80 | ACHE (0.47) | ACHEAPPSMN1; SMN2KDM4ETNF | |
| SCHEMBL27655552 | 0.78 | ACHE (0.45) | ACHEAPPSMN1; SMN2LMNAKDM4E |
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 |