Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | ACHE | P22303 | 2/20 | 0.36 |
| ▸ | ALPL | P05186 | 1/20 | 0.36 |
| ▸ | ALPI | P09923 | 1/20 | 0.36 |
| ▸ | ALPG | P10696 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | EED | O75530 | 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 | |
|---|---|---|---|---|
| SCHEMBL9083103 | 0.81 | KCNH2 (0.46) | NPSR1MEN1KMT2APOLBGAA | |
| SCHEMBL8960386 | 0.80 | ANPEP (0.48) | CYP1A2CYP2D6CYP2C19SMN1; SMN2LMNA | |
| SCHEMBL8960382 | 0.79 | ANPEP (0.47) | CYP1A2CYP2D6CYP2C19SMN1; SMN2ALPL | |
| SCHEMBL14064101 | 0.78 | MEN1 (0.62) | NPSR1MEN1KMT2APOLBGAA | |
| SCHEMBL9082704 | 0.76 | KCNH2 (0.44) | NPSR1MEN1KMT2APOLBKCNH2 | |
| SCHEMBL6220874 | 0.75 | KCNH2 (0.43) | NPSR1MEN1KMT2APOLBKCNH2 | |
| SCHEMBL8916827 | 0.74 | KCNH2 (0.42) | NPSR1MEN1KMT2APOLBKCNH2 | |
| SCHEMBL8915171 | 0.74 | KCNH2 (0.42) | NPSR1MEN1KMT2APOLBKCNH2 | |
| SCHEMBL8915431 | 0.74 | KCNH2 (0.42) | NPSR1MEN1KMT2APOLBKCNH2 | |
| SCHEMBL8916904 | 0.74 | KCNH2 (0.42) | NPSR1MEN1KMT2APOLBKCNH2 |
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-0491374-B1 | Bisphosphonic acid derivatives, their production and use | TAKEDA CHEMICAL INDUSTRIES LTD (JP) | 1996-01-31 | — | — | EP | disclosed |
| US-5280022-A | Containing an amine group | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1994-01-18 | — | — | US | disclosed |
| EP-0491374-A1 | Bisphosphonic acid derivatives, their production and use | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1992-06-24 | — | — | EP | disclosed |