Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACACB | O00763 | 2/20 | 0.43 |
| ▸ | TAS1R3 | Q7RTX0 | 3/20 | 0.43 |
| ▸ | TAS1R1 | Q7RTX1 | 3/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.43 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | STAT3 | P40763 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | RORC | P51449 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL13683175 | 0.85 | ACACB (0.43) | ACACBTAS1R3TAS1R1L3MBTL1MTNR1A | |
| SCHEMBL13683103 | 0.80 | CYP2D6 (0.47) | TAS1R3TAS1R1NPC1ALDH1A1 | |
| SCHEMBL16200314 | 0.78 | ALDH1A1 (0.38) | TAS1R3TAS1R1NPC1RAB9AMEN1 | |
| SCHEMBL16200302 | 0.76 | GAA (0.41) | L3MBTL1NPC1MEN1KMT2ALMNA | |
| SCHEMBL1754175 | 0.76 | CYP1A2 (0.46) | ACACBL3MBTL1SMN1; SMN2MEN1HTT | |
| SCHEMBL16200313 | 0.76 | PGK1 (0.41) | TAS1R3TAS1R1NPC1LMNAKDM4E | |
| SCHEMBL2107612 | 0.74 | TNFSF11 (0.46) | ACACBTAS1R3TAS1R1L3MBTL1NPC1 | |
| SCHEMBL2107613 | 0.74 | TNFSF11 (0.46) | ACACBTAS1R3TAS1R1L3MBTL1NPC1 | |
| SCHEMBL13178807 | 0.73 | GAA (0.46) | NPC1HTTLMNA | |
| SCHEMBL30202757 | 0.72 | GPR139 (0.47) | ACACBL3MBTL1NPC1RAB9AMEN1 |
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-1720545-B1 | BICYCLIC AND BRIDGED NITROGEN HETEROCYCLES | CHEMOCENTRYX INC (US) | 2014-10-29 | — | — | EP | disclosed |