Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | NEK2 | P51955 | 4/20 | 0.41 |
| ▸ | TGFBR1 | P36897 | 2/20 | 0.38 |
| ▸ | ACVR1 | Q04771 | 2/20 | 0.38 |
| ▸ | ATM | Q13315 | 2/20 | 0.38 |
| ▸ | FYN | P06241 | 2/20 | 0.37 |
| ▸ | MAP3K11 | Q16584 | 1/20 | 0.37 |
| ▸ | PLK1 | P53350 | 1/20 | 0.37 |
| ▸ | NEK1 | Q96PY6 | 1/20 | 0.37 |
| ▸ | ACVR1B | P36896 | 1/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.37 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.36 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | FKBP1A | P62942 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL4122440 | 0.83 | TGFBR1 (0.43) | TGFBR1ACVR1FYNMAP3K11ACVR1B | |
| SCHEMBL6168415 | 0.82 | ALDH1A1 (0.55) | ALDH1A1HPGDKCNH2SMN1; SMN2LMNA | |
| SCHEMBL4122610 | 0.78 | KDM4E (0.61) | ALDH1A1KDM4EHPGDSMN1; SMN2KMT2A | |
| SCHEMBL4127097 | 0.77 | LMNA (0.40) | ALDH1A1TGFBR1ACVR1MAP3K11ACVR1B | |
| SCHEMBL4117314 | 0.76 | KCNH2 (0.39) | ALDH1A1TGFBR1ACVR1MAP3K11ACVR1B | |
| SCHEMBL13813594 | 0.75 | SLC6A2 (0.40) | TGFBR1ACVR1FYNMAP3K11ACVR1B | |
| SCHEMBL4108306 | 0.75 | TGFBR1 (0.38) | ALDH1A1KDM4ETGFBR1ACVR1MAP3K11 | |
| SCHEMBL4109512 | 0.75 | SLC6A2 (0.41) | ALDH1A1TGFBR1ACVR1MAP3K11ACVR1B | |
| SCHEMBL4763695 | 0.73 | CXCR4 (0.48) | ALDH1A1KDM4ETGFBR1ACVR1ACVR1B | |
| SCHEMBL6167568 | 0.73 | ALDH1A1 (0.54) | ALDH1A1KDM4EHPGDKCNH2SMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1494670-A1 | MEDICINE FOR TREATING CANCER | Kowa Co., Ltd. (JP) | 2005-01-12 | — | — | EP | disclosed |
| WO-2003086397-A1 | MEDICINE FOR TREATING CANCER | KOWA CO., LTD. (JP) | 2003-10-23 | — | — | WO | disclosed |