Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | JMJD6 | Q6NYC1 | 1/20 | 0.39 |
| ▸ | TSPO | P30536 | 2/20 | 0.38 |
| ▸ | PDK1 | Q15118 | 5/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.37 |
| ▸ | PTGES | O14684 | 1/20 | 0.37 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.37 |
| ▸ | LTC4S | Q16873 | 1/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | GLA | P06280 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL14944354 | 0.88 | JMJD6 (0.41) | TSHRGAAJMJD6TSPOPDK1 | |
| SCHEMBL14931676 | 0.86 | TSHR (0.46) | TSHRGAATSPOPDK1KMT2A | |
| SCHEMBL10157089 | 0.80 | TSPO (0.42) | TSHRGAATSPOPDK1PTGES | |
| SCHEMBL10157569 | 0.80 | GABRP (0.46) | TSHRGAATSPOPDK1PTGES | |
| SCHEMBL14931869 | 0.78 | HDAC1 (0.41) | JMJD6TSPOKMT2AALDH1A1MAPT | |
| SCHEMBL3336342 | 0.76 | GAA (0.50) | TSHRGAAPDK1KMT2ATDP1 | |
| SCHEMBL14931827 | 0.74 | TSHR (0.45) | TSHRGAATSPOPDK1KMT2A | |
| SCHEMBL14944371 | 0.74 | KDM6A (0.49) | — | |
| SCHEMBL25920400 | 0.72 | RAB9A (0.53) | TSPOKMT2ASLC6A2SLC6A3ALDH1A1 | |
| SCHEMBL25920399 | 0.72 | CHRM2 (0.43) | PDK1PTGESALOX5LTC4SALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2592154-A1 | Immobilization products and methods for the identification of histone demethylase interacting molecules and for the purification of histone demethylase proteins | CELLZOME AG (DE) | 2013-05-15 | — | — | EP | disclosed |
| 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 |