Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 2/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | TAS1R3 | Q7RTX0 | 3/20 | 0.48 |
| ▸ | TAS1R1 | Q7RTX1 | 3/20 | 0.48 |
| ▸ | TAS1R2 | Q8TE23 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.46 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.46 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.46 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.46 |
| ▸ | USP2 | O75604 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL12130659 | 0.88 | PDPK1 (0.53) | HTTLMNAPDPK1TSHRTAS1R3 | |
| SCHEMBL13164295 | 0.88 | PDPK1 (0.53) | HTTLMNAPDPK1TSHRTAS1R3 | |
| SCHEMBL10159937 | 0.88 | PDPK1 (0.53) | HTTLMNAPDPK1TSHRTAS1R3 | |
| SCHEMBL1736569 | 0.84 | ALDH1A1 (0.51) | HTTLMNAPDPK1TSHRTAS1R3 | |
| SCHEMBL10159758 | 0.83 | PDPK1 (0.51) | HTTLMNAPDPK1TSHRTAS1R3 | |
| SCHEMBL14438322 | 0.80 | PDPK1 (0.65) | HTTLMNAPDPK1TSHRADRA2B | |
| SCHEMBL14438319 | 0.80 | PDPK1 (0.65) | HTTLMNAPDPK1TSHRADRA2B | |
| SCHEMBL9144137 | 0.80 | PDPK1 (0.65) | HTTLMNAPDPK1TSHRADRA2B | |
| SCHEMBL6678910 | 0.79 | HTT (0.58) | HTTLMNATSHRTAS1R3TAS1R1 | |
| SCHEMBL6678912 | 0.79 | HTT (0.58) | HTTLMNATSHRTAS1R3TAS1R1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2231679-B1 | SYNTHESIS OF BIGUANIDINES AND TRIAZINES, AND BIGUANIDINO-ALUMINIUM COMPLEXES AS INTERMEDIATES | BAYER CROPSCIENCE AG (DE) | 2011-11-16 | — | — | EP | disclosed |