Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | CASP1 | P29466 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.51 |
| ▸ | MAPT | P10636 | 4/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 3/20 | 0.48 |
| ▸ | NPC1 | O15118 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 2/20 | 0.44 |
| ▸ | ERCC5 | P28715 | 1/20 | 0.44 |
| ▸ | FEN1 | P39748 | 1/20 | 0.44 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.44 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 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 | |
|---|---|---|---|---|
| SCHEMBL15912483 | 0.83 | FLT1 (0.41) | SMN1; SMN2TSHRCASP1ALDH1A1MAPT | |
| SCHEMBL9449001 | 0.83 | ALDH1A1 (0.44) | SMN1; SMN2TSHRCASP1ALDH1A1MAPT | |
| SCHEMBL9449019 | 0.83 | HPGD (0.47) | SMN1; SMN2ALDH1A1MAPTHIF1ARAB9A | |
| SCHEMBL9448913 | 0.79 | JAK2 (0.47) | SMN1; SMN2ALDH1A1MAPTMAPK1RAB9A | |
| SCHEMBL9449037 | 0.79 | ABCG2 (0.49) | MAPTNPC1CXCL12L3MBTL1MEN1 | |
| SCHEMBL9449288 | 0.78 | CES2 (0.52) | TSHRALDH1A1HIF1ARAB9AHPGD | |
| SCHEMBL1697502 | 0.77 | SMN1; SMN2 (0.61) | SMN1; SMN2TSHRCASP1ALDH1A1MAPT | |
| SCHEMBL30513965 | 0.77 | SMN1; SMN2 (0.61) | SMN1; SMN2TSHRCASP1ALDH1A1MAPT | |
| SCHEMBL9449241 | 0.76 | ALDH1A1 (0.40) | TSHRALDH1A1MAPTMAPK1HIF1A | |
| SCHEMBL1349424 | 0.76 | SMN1; SMN2 (0.59) | SMN1; SMN2TSHRCASP1ALDH1A1MAPT |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0466730-B1 | GEMINAL BISPHOSPHONIC ACIDS AND DERIVATIVES AS ANTI-ARTHRITIC AGENTS | THE UPJOHN COMPANY (US) | 1993-07-21 | — | — | EP | disclosed |
| US-5220021-A | Geminal bisphosphonic acids and derivatives as anti-arthritic agents | THE UPJOHN COMPANY (US) | 1993-06-15 | — | — | US | disclosed |
| WO-1990012017-A1 | GEMINAL BISPHOSPHONIC ACIDS AND DERIVATIVES AS ANTI-ARTHRITIC AGENTS | THE UPJOHN COMPANY (US) | 1990-10-18 | — | — | WO | disclosed |