Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | METAP2 | P50579 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 2/20 | 0.35 |
| ▸ | CA2 | P00918 | 2/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | RXRA | P19793 | 1/20 | 0.35 |
| ▸ | RXRB | P28702 | 1/20 | 0.35 |
| ▸ | RXRG | P48443 | 1/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.34 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.33 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.33 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.33 |
| ▸ | AGTR2 | P50052 | 1/20 | 0.32 |
| ▸ | IDH1 | O75874 | 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 | |
|---|---|---|---|---|
| SCHEMBL13566081 | 0.84 | MAPT (0.33) | METAP2CA1CA2HTTNPSR1 | |
| SCHEMBL13565223 | 0.83 | METAP2 (0.41) | METAP2HTTSMN1; SMN2NPSR1RXRA | |
| SCHEMBL11935308 | 0.83 | HTT (0.56) | METAP2HTTSMN1; SMN2NPSR1RXRA | |
| SCHEMBL13565335 | 0.82 | PARP1 (0.42) | METAP2CA1CA2HTTSMN1; SMN2 | |
| SCHEMBL11935984 | 0.81 | SMN1; SMN2 (0.38) | METAP2CA1CA2HTTSMN1; SMN2 | |
| SCHEMBL10116311 | 0.78 | MAPT (0.46) | CA1CA2HTTSMN1; SMN2NR1H4 | |
| SCHEMBL13565011 | 0.78 | CA1 (0.53) | CA1CA2HTTSMN1; SMN2CA12 | |
| SCHEMBL13565046 | 0.78 | MAPT (0.55) | HTTSMN1; SMN2IDH1 | |
| SCHEMBL11935980 | 0.77 | PTPN11 (0.43) | CA1CA2SMN1; SMN2IDH1 | |
| SCHEMBL13566043 | 0.76 | MAOB (0.34) | CA1CA2CA12CA9 |
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 |
|---|---|---|---|---|---|---|---|
| US-9139518-B2 | Amine derivative having NPY Y5 receptor antagonistic activity | SHIONOGI & CO., LTD. (JP) | 2015-09-22 | — | — | US | disclosed |
| US-8299265-B2 | Amine derivatives having NPY Y5 receptor antagonistic activity and the uses thereof | SHIONOGI & CO., LTD. (JP) | 2012-10-30 | — | — | US | disclosed |