Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 1/20 | 0.44 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.44 |
| ▸ | HTR2B | P41595 | 1/20 | 0.44 |
| ▸ | DRD2 | P14416 | 1/20 | 0.40 |
| ▸ | DRD4 | P21917 | 1/20 | 0.40 |
| ▸ | DRD3 | P35462 | 1/20 | 0.40 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.38 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.38 |
| ▸ | NOS3 | P29474 | 1/20 | 0.38 |
| ▸ | NOS1 | P29475 | 1/20 | 0.38 |
| ▸ | NOS2 | P35228 | 1/20 | 0.38 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.37 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.36 |
| ▸ | CDK1 | P06493 | 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 | |
|---|---|---|---|---|
| SCHEMBL6509095 | 0.87 | DRD2 (0.40) | DRD2DRD4DRD3RAB9ANPC1 | |
| SCHEMBL6509412 | 0.84 | DRD2 (0.35) | HTR2CSLC6A4HTR2BDRD2DRD4 | |
| SCHEMBL6509735 | 0.80 | SMN1; SMN2 (0.52) | DRD2DRD4DRD3RAB9ANPC1 | |
| SCHEMBL9529209 | 0.72 | DRD2 (0.71) | DRD2DRD4DRD3SMN1; SMN2NOS3 | |
| SCHEMBL6509803 | 0.69 | SMN1; SMN2 (0.50) | RAB9ANPC1SMN1; SMN2TP53HPGD | |
| SCHEMBL12301152 | 0.67 | L3MBTL1 (0.54) | DRD2DRD4DRD3SMN1; SMN2CYP11B1 | |
| SCHEMBL15515962 | 0.67 | HTR1A (0.54) | CYP11B1CYP11B2KCNH2HPGD | |
| SCHEMBL6654775 | 0.67 | PDE3B (0.43) | DRD2DRD4DRD3TP53KDM4E | |
| SCHEMBL22894194 | 0.66 | KMT2A (0.60) | DRD2DRD4DRD3NPC1TAAR1 | |
| SCHEMBL19012412 | 0.66 | KMT2A (0.60) | DRD2DRD4DRD3NPC1TAAR1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2005110982-A2 | SUBSTITUTED 1-BENZYL-4-SUBSTITUTED PIPERAZINE ANALOGUES | NEUROGEN CORPORATION (US) | 2005-11-24 | — | — | WO | disclosed |