Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | CNR2 | P34972 | 4/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 2/20 | 0.38 |
| ▸ | CA1 | P00915 | 2/20 | 0.38 |
| ▸ | CA2 | P00918 | 2/20 | 0.38 |
| ▸ | CA9 | Q16790 | 2/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | HTR2C | P28335 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | CA7 | P43166 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 3/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 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 | |
|---|---|---|---|---|
| SCHEMBL17089960 | 1.00 | NPC1 (0.42) | NPC1RAB9ACNR2ALDH1A1GAA | |
| SCHEMBL17089951 | 0.89 | NPC1 (0.41) | NPC1RAB9ACNR2ALDH1A1GAA | |
| SCHEMBL13565186 | 0.88 | ACACB (0.40) | CNR2ALDH1A1GAAMAPK1KDM4E | |
| SCHEMBL17090520 | 0.88 | ACACB (0.40) | CNR2ALDH1A1GAAMAPK1KDM4E | |
| SCHEMBL13565621 | 0.88 | THRB (0.42) | NPC1RAB9ACNR2ALDH1A1KDM4E | |
| SCHEMBL17090307 | 0.88 | THRB (0.42) | NPC1RAB9ACNR2ALDH1A1KDM4E | |
| SCHEMBL17090167 | 0.87 | NPY5R (0.38) | CNR2ALDH1A1GAAMAPK1KDM4E | |
| SCHEMBL13564763 | 0.86 | CNR2 (0.37) | CNR2LMNAPOLB | |
| SCHEMBL17089955 | 0.86 | CNR2 (0.37) | CNR2LMNAPOLB | |
| SCHEMBL11935226 | 0.86 | ACHE (0.46) | CNR2ALDH1A1GAAMAPTCA12 |
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 |
|---|---|---|---|---|---|---|---|
| US-8299265-B2 | Amine derivatives having NPY Y5 receptor antagonistic activity and the uses thereof | SHIONOGI & CO., LTD. (JP) | 2012-10-30 | — | — | US | disclosed |