Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CXCR4 | P61073 | 9/20 | 0.51 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.40 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.40 |
| ▸ | CCR2 | P41597 | 1/20 | 0.40 |
| ▸ | CXCL12 | P48061 | 1/20 | 0.40 |
| ▸ | BLM | P54132 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | HRH2 | P25021 | 1/20 | 0.36 |
| ▸ | HRH1 | P35367 | 1/20 | 0.36 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.36 |
| ▸ | CHRM3 | P20309 | 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 | |
|---|---|---|---|---|
| SCHEMBL687467 | 0.94 | CXCR4 (0.44) | CXCR4SIGMAR1MEN1KMT2ACHRM1 | |
| SCHEMBL18138091 | 0.92 | TSHR (0.42) | CXCR4SIGMAR1MEN1KMT2ATSHR | |
| SCHEMBL1341702 | 0.91 | TSHR (0.43) | SIGMAR1MEN1KMT2ATSHRLMNA | |
| Hydrochloric Acid SCHEMBL16528079 | 0.89 | TSHR (0.42) | SIGMAR1MEN1KMT2ATSHRLMNA | |
| Hydrochloric Acid SCHEMBL4123503 | 0.89 | TSHR (0.42) | SIGMAR1MEN1KMT2ATSHRLMNA | |
| SCHEMBL3569267 | 0.88 | CXCR4 (0.51) | CXCR4SIGMAR1HRH3TSHRALDH1A1 | |
| SCHEMBL3573206 | 0.87 | CXCR4 (0.53) | CXCR4SIGMAR1TDP1HRH3TSHR | |
| Ethyl Propionate SCHEMBL11668791 | 0.86 | TSHR (0.40) | SIGMAR1MEN1KMT2ATSHRLMNA | |
| SCHEMBL4444447 | 0.85 | SIGMAR1 (0.51) | CXCR4SIGMAR1MEN1KMT2ACHRM2 | |
| SCHEMBL16267253 | 0.85 | TSHR (0.40) | SIGMAR1HRH3TSHRLMNAPOLB |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2109632-A2 | MATERIAL COMPRISING POLYAZACYCLOALKANES GRAFTED ONTO POLYPROPYLENE FIBRES METHOD FOR PRODUCTION THEREOF AND METHOD FOR REMOVAL OF METAL CATIONS FROM A LIQUID | Commissariat à l'Energie Atomique (FR) | 2009-10-21 | — | — | EP | disclosed |
| WO-2008099114-A2 | MATERIAL COMPRISING POLYAZACYCLOALKANES GRAFTED ONTO POLYPROPYLENE FIBRES METHOD FOR PRODUCTION THEREOF AND METHOD FOR REMOVAL OF METAL CATIONS FROM A LIQUID | COMMISSARIAT A L'ENERGIE ATOMIQUE (FR) | 2008-08-21 | — | — | WO | disclosed |