Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 13/20 | 0.46 |
| ▸ | HRH1 | P35367 | 13/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | HTR2C | P28335 | 10/20 | 0.40 |
| ▸ | DRD2 | P14416 | 3/20 | 0.40 |
| ▸ | ADRA2C | P18825 | 3/20 | 0.40 |
| ▸ | DRD3 | P35462 | 3/20 | 0.40 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.40 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.40 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.38 |
| ▸ | DRD1 | P21728 | 1/20 | 0.38 |
| ▸ | HTR7 | P34969 | 1/20 | 0.38 |
| ▸ | HTR3E | A5X5Y0 | 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 | |
|---|---|---|---|---|
| SCHEMBL18462680 | 0.82 | ACE (0.37) | HTR2AHRH1TDP1HTR2CADRA2C | |
| SCHEMBL19440248 | 0.82 | ACE (0.37) | HTR2AHRH1TDP1HTR2CADRA2C | |
| SCHEMBL172922 | 0.78 | HTR2A (0.49) | HTR2AHRH1ALDH1A1MAPTHPGD | |
| SCHEMBL5334773 | 0.77 | ACE (0.45) | MAPTKCNH2DRD4 | |
| SCHEMBL15701679 | 0.75 | CXCR4 (0.46) | HTR2AHRH1ALDH1A1MAPTHPGD | |
| SCHEMBL12921565 | 0.74 | DRD4 (0.45) | HTR2AHRH1MAPTTDP1HTR2C | |
| SCHEMBL14985698 | 0.74 | DRD4 (0.45) | HTR2AHRH1MAPTTDP1HTR2C | |
| SCHEMBL13560083 | 0.73 | ACE (0.47) | HTR2AHRH1ALDH1A1MAPTHPGD | |
| SCHEMBL4856520 | 0.73 | CACNA1G (0.41) | DRD4 | |
| SCHEMBL4737669 | 0.71 | PRCP (0.40) | HTR2AHRH1TDP1HTR2CADRA2C |
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-7851637-B2 | Compounds and methods for inhibiting the interaction of BCL proteins with binding partners | INFINITY PHARMACEUTICALS, INC. (US) | 2010-12-14 | — | — | US | disclosed |