Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CXCR4 | P61073 | 1/20 | 0.34 |
| ▸ | ADRA1D | P25100 | 3/20 | 0.31 |
| ▸ | ADRA1A | P35348 | 3/20 | 0.31 |
| ▸ | ADRA1B | P35368 | 3/20 | 0.31 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.31 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.31 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.31 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.31 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Iodide SCHEMBL2415765 | 0.98 | CXCR4 (0.33) | CXCR4ADRA1DADRA1AADRA1BS1PR4 | |
| SCHEMBL11795952 | 0.91 | S1PR1 (0.42) | S1PR4S1PR1S1PR3S1PR5 | |
| SCHEMBL10801003 | 0.75 | CXCR4 (0.34) | CXCR4S1PR4S1PR1S1PR3S1PR5 | |
| SCHEMBL10800672 | 0.72 | CXCR4 (0.31) | CXCR4 | |
| SCHEMBL11558776 | 0.72 | — | — | |
| SCHEMBL11705381 | 0.69 | EBP (0.41) | S1PR4S1PR1S1PR3S1PR5 | |
| SCHEMBL11317907 | 0.69 | — | — | |
| SCHEMBL4113851 | 0.67 | KEAP1 (0.31) | — | |
| Hydrochloric Acid SCHEMBL11429412 | 0.67 | S1PR1 (0.41) | S1PR4S1PR1S1PR3S1PR5 | |
| SCHEMBL11305147 | 0.66 | OPRD1 (0.31) | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0472093-B1 | Bis guanidines and fungicides containing same | BASF AG (DE) | 1993-11-03 | — | — | EP | claimed |
| EP-2275100-A2 | Compounds with anti-parasitic activity and drugs containing said compounds | Centre National de la Recherche Scientifique (CNRS) (FR) | 2011-01-19 | — | — | EP | disclosed |
| EP-2266555-A2 | Compounds with antiparasitic activity and medicines containing same | Centre National de la Recherche Scientifique (CNRS) (FR) | 2010-12-29 | — | — | EP | disclosed |
| EP-2260840-A2 | Compounds with antiparasitic activity and medicines containing same | Centre National de la Recherche Scientifique (CNRS) (FR) | 2010-12-15 | — | — | EP | disclosed |
| EP-2260841-A2 | Compounds with antiparasitic activity and medicines containing same | Centre National de la Recherche Scientifique (CNRS) (FR) | 2010-12-15 | — | — | EP | disclosed |
| US-5302620-A | Bisguanidines and fungicides containing them | BASF AKTIENGESELLSCHAFT (DE) | 1994-04-12 | — | — | US | disclosed |
| US-5242948-A | BISGUANIDINES AND FUNGICIDES CONTAINING THEM | BASF AKTIENGESELLSCHAFT (DE) | 1993-09-07 | — | — | US | disclosed |