Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.63 |
| ▸ | HPGD | P15428 | 2/20 | 0.63 |
| ▸ | CA1 | P00915 | 2/20 | 0.57 |
| ▸ | CA2 | P00918 | 2/20 | 0.57 |
| ▸ | RAB9A | P51151 | 6/20 | 0.56 |
| ▸ | LMNA | P02545 | 1/20 | 0.56 |
| ▸ | NPC1 | O15118 | 3/20 | 0.55 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.55 |
| ▸ | KIF11 | P52732 | 1/20 | 0.53 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | CRHBP | P24387 | 1/20 | 0.49 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL18602130 | 0.88 | CA1 (0.55) | SMN1; SMN2HPGDCA1CA2RAB9A | |
| SCHEMBL104611 | 0.81 | SMN1; SMN2 (0.67) | SMN1; SMN2HPGDCA1CA2RAB9A | |
| SCHEMBL12545584 | 0.81 | SMN1; SMN2 (0.67) | SMN1; SMN2HPGDCA1CA2RAB9A | |
| SCHEMBL26078967 | 0.81 | SMN1; SMN2 (0.58) | SMN1; SMN2HPGDRAB9ALMNANPC1 | |
| SCHEMBL5324688 | 0.80 | SMN1; SMN2 (0.65) | SMN1; SMN2HPGDRAB9ALMNANPC1 | |
| SCHEMBL11207364 | 0.80 | SMN1; SMN2 (0.65) | SMN1; SMN2HPGDRAB9ALMNANPC1 | |
| SCHEMBL25848804 | 0.80 | SMN1; SMN2 (0.65) | SMN1; SMN2HPGDCA1CA2RAB9A | |
| SCHEMBL5440304 | 0.80 | TSHR (0.73) | SMN1; SMN2HPGDCA1CA2RAB9A | |
| SCHEMBL12018050 | 0.80 | PTPN1 (0.73) | SMN1; SMN2HPGDRAB9ALMNANPC1 | |
| SCHEMBL11193183 | 0.80 | SMN1; SMN2 (0.65) | SMN1; SMN2HPGDRAB9ALMNANPC1 |
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-2021148003-A1 | DRUG CONJUGATE OF ERIBULIN DERIVATIVE, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF IN MEDICINE | 上海森辉医药有限公司 | 2021-07-29 | — | — | WO | disclosed |