Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | RXRA | P19793 | 1/20 | 0.37 |
| ▸ | RXRB | P28702 | 1/20 | 0.37 |
| ▸ | RXRG | P48443 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.36 |
| ▸ | PNMT | P11086 | 1/20 | 0.34 |
| ▸ | AGTR2 | P50052 | 1/20 | 0.34 |
| ▸ | METAP2 | P50579 | 1/20 | 0.33 |
| ▸ | ITGA1 | P56199 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | JAK2 | O60674 | 1/20 | 0.32 |
| ▸ | BRD4 | O60885 | 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 | |
|---|---|---|---|---|
| SCHEMBL13565712 | 0.84 | NPC1 (0.43) | NPC1RAB9ASMN1; SMN2HTTNPSR1 | |
| SCHEMBL11935308 | 0.83 | HTT (0.56) | SMN1; SMN2HTTNPSR1RXRARXRB | |
| SCHEMBL10116309 | 0.79 | NPC1 (0.54) | NPC1RAB9AHTTNPSR1MAPT | |
| SCHEMBL15671164 | 0.78 | RAB9A (0.51) | NPC1RAB9ASMN1; SMN2HTTNPSR1 | |
| SCHEMBL13565626 | 0.76 | PSIP1 (0.44) | HSD17B10HDAC6CA1CA2 | |
| SCHEMBL11935952 | 0.76 | NPC1 (0.47) | NPC1RAB9ASMN1; SMN2HTTNPSR1 | |
| SCHEMBL13564926 | 0.75 | NPC1 (0.45) | NPC1RAB9ASMN1; SMN2HTTNPSR1 | |
| SCHEMBL13565494 | 0.74 | SCD (0.44) | — | |
| SCHEMBL13564999 | 0.74 | CA1 (0.50) | HTTCA1CA2 | |
| SCHEMBL13565011 | 0.73 | CA1 (0.53) | SMN1; SMN2HTTMAPTHPGDHSD17B10 |
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 |