Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 4/20 | 0.37 |
| ▸ | THRB | P10828 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | EED | O75530 | 1/20 | 0.33 |
| ▸ | PPARD | Q03181 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL5274699 | 0.79 | CYP3A4 (0.42) | CYP3A4CYP2C9CYP2C19GAATHRB | |
| SCHEMBL5276732 | 0.78 | GAA (0.42) | CYP3A4CYP2C9CYP2C19GAATHRB | |
| SCHEMBL18825530 | 0.76 | CYP3A4 (0.46) | CYP3A4CYP2C9CYP2C19GAATHRB | |
| SCHEMBL12232709 | 0.76 | GAA (0.43) | CYP3A4CYP2C9CYP2C19GAATHRB | |
| SCHEMBL5274704 | 0.76 | GAA (0.43) | CYP3A4CYP2C9CYP2C19GAATHRB | |
| SCHEMBL5273085 | 0.75 | GAA (0.40) | CYP3A4CYP2C9CYP2C19GAATHRB | |
| SCHEMBL28902008 | 0.74 | ALOX15 (0.39) | CYP3A4CYP2C9CYP2C19GAATHRB | |
| SCHEMBL5276735 | 0.73 | GAA (0.41) | CYP3A4CYP2C9CYP2C19GAATHRB | |
| SCHEMBL5007400 | 0.72 | GAA (0.43) | CYP3A4CYP2C9CYP2C19GAATHRB | |
| SCHEMBL10910425 | 0.72 | GAA (0.46) | CYP3A4CYP2C9CYP2C19GAATHRB |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0546548-B1 | Guanidinyl alkyl-1,1-bis phosphonic acid derivatives, process for their preparation and their use | HOECHST AG (DE) | 1997-05-02 | — | — | EP | claimed |
| US-5294608-A | Compounds for treatment of osteoporosis and bone disorders | HOECHST AKTIENGESELLSCHAFT (DE) | 1994-03-15 | — | — | US | claimed |
| EP-0546548-A1 | Guanidinyl alkyl-1,1-bis phosphonic acid derivatives, process for their preparation and their use | HOECHST AKTIENGESELLSCHAFT (DE) | 1993-06-16 | — | — | EP | claimed |
| JP-5271260-A | — | — | None | — | — | JP | disclosed |
| EP-0546548-B1 | Guanidinyl alkyl-1,1-bis phosphonic acid derivatives, process for their preparation and their use | HOECHST AG (DE) | 1997-05-02 | — | — | EP | disclosed |
| US-5294608-A | Compounds for treatment of osteoporosis and bone disorders | HOECHST AKTIENGESELLSCHAFT (DE) | 1994-03-15 | — | — | US | disclosed |
| JP-H05271260-A | GUANIDINOALKYL-1,1-BISPHOSPHONIC ACID DERIVATIVES, ITS PRODUCTION AND THEIR USE | HOECHST AG | 1993-10-19 | — | — | JP | disclosed |
| EP-0546548-A1 | Guanidinyl alkyl-1,1-bis phosphonic acid derivatives, process for their preparation and their use | HOECHST AKTIENGESELLSCHAFT (DE) | 1993-06-16 | — | — | EP | disclosed |