Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 9/20 | 0.45 |
| ▸ | NPC1 | O15118 | 8/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 7/20 | 0.45 |
| ▸ | ACACB | O00763 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | CASP3 | P42574 | 1/20 | 0.39 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | MITF | O75030 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL13565441 | 1.00 | RAB9A (0.45) | RAB9ANPC1SMN1; SMN2ACACBLMNA | |
| SCHEMBL13439057 | 0.86 | RAB9A (0.45) | RAB9ANPC1SMN1; SMN2ACACBLMNA | |
| SCHEMBL11935340 | 0.86 | RAB9A (0.45) | RAB9ANPC1SMN1; SMN2ACACBLMNA | |
| SCHEMBL17090372 | 0.86 | ALDH1A1 (0.38) | ACACBLMNAALDH1A1MAPTKDM4E | |
| SCHEMBL13565861 | 0.86 | ALDH1A1 (0.38) | ACACBLMNAALDH1A1MAPTKDM4E | |
| SCHEMBL10114968 | 0.83 | RAB9A (0.51) | RAB9ANPC1SMN1; SMN2ACACBLMNA | |
| SCHEMBL13204443 | 0.83 | RAB9A (0.51) | RAB9ANPC1SMN1; SMN2ACACBLMNA | |
| SCHEMBL10116154 | 0.80 | SMN1; SMN2 (0.52) | RAB9ANPC1SMN1; SMN2ACACBLMNA | |
| SCHEMBL13565085 | 0.79 | HRH3 (0.37) | ACACBLMNAALDH1A1 | |
| SCHEMBL17090370 | 0.79 | HRH3 (0.37) | ACACBLMNAALDH1A1 |
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-9139518-B2 | Amine derivative having NPY Y5 receptor antagonistic activity | SHIONOGI & CO., LTD. (JP) | 2015-09-22 | — | — | US | disclosed |