Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.43 |
| ▸ | PTK2B | Q14289 | 1/20 | 0.43 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL11338656 | 0.86 | TSHR (0.56) | TSHRALDH1A1HSD17B10MAPK1TDP1 | |
| SCHEMBL4325991 | 0.84 | SLC6A3 (0.50) | TSHRALDH1A1HSD17B10MAPK1TDP1 | |
| SCHEMBL28020518 | 0.83 | TSHR (0.65) | TSHRALDH1A1HSD17B10MAPK1TDP1 | |
| SCHEMBL11341203 | 0.79 | TSHR (0.59) | TSHRALDH1A1HSD17B10MAPK1TDP1 | |
| SCHEMBL22979125 | 0.79 | TSHR (0.62) | TSHRALDH1A1HSD17B10TDP1KDM4E | |
| SCHEMBL13158928 | 0.79 | TSHR (0.62) | TSHRALDH1A1HSD17B10TDP1KDM4E | |
| SCHEMBL23229163 | 0.78 | TBXAS1 (0.45) | TSHRALDH1A1TDP1KDM4ESMN1; SMN2 | |
| SCHEMBL9959610 | 0.77 | TSHR (0.59) | TSHRALDH1A1HSD17B10MAPK1TDP1 | |
| SCHEMBL10375524 | 0.77 | TSHR (0.59) | TSHRALDH1A1HSD17B10KDM4ESMN1; SMN2 | |
| SCHEMBL28974979 | 0.76 | TSHR (0.74) | TSHRALDH1A1HSD17B10MAPK1TDP1 |
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-2027123-A2 | COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS | IRM LLC (BM) | 2009-02-25 | — | — | EP | disclosed |
| WO-2007134259-A2 | COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS | IRM LLC (BM) | 2007-11-22 | — | — | WO | disclosed |