Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | CASP2 | P42575 | 1/20 | 0.33 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.33 |
| ▸ | LPAR1 | Q92633 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | PSMB5 | P28074 | 2/20 | 0.32 |
| ▸ | NAAA | Q02083 | 1/20 | 0.31 |
| ▸ | FAAH | O00519 | 4/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | CNR1 | P21554 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL27368756 | 0.84 | LMNA (0.44) | LMNAALDH1A1CASP2MCL1LPAR1 | |
| SCHEMBL464448 | 0.83 | — | — | |
| Hydrochloric Acid SCHEMBL11654825 | 0.80 | — | — | |
| SCHEMBL12582325 | 0.80 | ALDH1A1 (0.39) | RECQLLMNAALDH1A1CASP2LPAR1 | |
| SCHEMBL16307753 | 0.79 | CASP2 (0.48) | RECQLLMNAGAACASP2PSMB5 | |
| SCHEMBL1463416 | 0.78 | CA1 (0.38) | RECQLLMNAALDH1A1MCL1 | |
| SCHEMBL22064537 | 0.78 | CA1 (0.38) | RECQLLMNAALDH1A1MCL1 | |
| SCHEMBL14002750 | 0.78 | ALDH1A1 (0.48) | ALDH1A1CASP2LPAR1TSHRNAAA | |
| SCHEMBL24080619 | 0.77 | CASP2 (0.47) | RECQLLMNAGAACASP2PSMB5 | |
| SCHEMBL31758445 | 0.77 | CASP2 (0.47) | RECQLLMNAGAACASP2PSMB5 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012052390-A1 | N-2-(2-PYRIDINYL)-4-PYRIMIDINYL-BETA-ALANINE DERIVATIVES AS INHIBITORS OF HISTONE DEMETHYLASE JMJD3 | GLAXO GROUP LIMITED (GB) | 2012-04-26 | — | — | WO | disclosed |