Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.38 |
| ▸ | MAOB | P27338 | 3/20 | 0.37 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.36 |
| ▸ | LTA4H | P09960 | 1/20 | 0.36 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | PARP14 | Q460N5 | 1/20 | 0.36 |
| ▸ | PARP10 | Q53GL7 | 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 | |
|---|---|---|---|---|
| SCHEMBL29263961 | 0.83 | NPC1 (0.60) | NPC1RAB9AMAOBGPR84LTA4H | |
| SCHEMBL31552396 | 0.81 | ALDH1A1 (0.48) | NPC1MAOBALDH1A1 | |
| SCHEMBL15400449 | 0.78 | MAOA (0.51) | NPC1RAB9AMAOBMAOA | |
| SCHEMBL18919802 | 0.78 | KCNA3 (0.52) | NPC1RAB9ATAAR1LTA4HALDH1A1 | |
| SCHEMBL22171125 | 0.78 | TAAR1 (0.47) | NPC1TAAR1MAOBLTA4HALDH1A1 | |
| SCHEMBL15435176 | 0.77 | FFAR1 (0.49) | NPC1RAB9AMAOBMAOA | |
| SCHEMBL15435287 | 0.76 | FFAR1 (0.48) | NPC1RAB9AMAOBMAOA | |
| SCHEMBL13577160 | 0.76 | DRD4 (0.52) | SIRT2TAAR1MAOBGPR84ALDH1A1 | |
| SCHEMBL5469306 | 0.75 | SLC6A2 (0.46) | SLC6A2SLC6A4SLC6A3MAOBMAOA | |
| SCHEMBL18361759 | 0.75 | TSHR (0.49) | NPC1RAB9ALTA4HALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-101437820-A | Heterobicyclic pyrazole compounds and methods of use | ARRAY BIOPHARMA INC (US) | 2009-05-20 | — | — | CN | disclosed |