Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 1/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.51 |
| ▸ | SIGMAR1 | Q99720 | 5/20 | 0.47 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.46 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.46 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.46 |
| ▸ | MC4R | P32245 | 1/20 | 0.44 |
| ▸ | ACHE | P22303 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | DRD2 | P14416 | 1/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.41 |
| ▸ | HTR2C | P28335 | 1/20 | 0.41 |
| ▸ | HTR2B | P41595 | 1/20 | 0.41 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.41 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.41 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.41 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.41 |
| ▸ | DRD3 | P35462 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL6672942 | 0.81 | SIGMAR1 (0.62) | SIGMAR1MC4RACHECYP1A2HTR2C | |
| SCHEMBL4000995 | 0.79 | SIGMAR1 (0.54) | MAPTTDP1SIGMAR1MC4RACHE | |
| Hydrochloric Acid SCHEMBL16713355 | 0.79 | SIGMAR1 (0.60) | SIGMAR1MC4RACHECYP1A2HTR2C | |
| SCHEMBL30978695 | 0.75 | SIGMAR1 (0.60) | TDP1SIGMAR1MC4RACHE | |
| SCHEMBL30073105 | 0.75 | SIGMAR1 (0.60) | SIGMAR1MC4RCYP1A2MEN1KMT2A | |
| SCHEMBL20060315 | 0.74 | NR3C1 (0.45) | MAPTTDP1SIGMAR1ADRA1DADRA1A | |
| SCHEMBL8450698 | 0.74 | SIGMAR1 (0.58) | TDP1SIGMAR1MC4RACHECYP1A2 | |
| SCHEMBL12773114 | 0.72 | ADRA1D (0.42) | MAPTTDP1ADRA1DADRA1AADRA1B | |
| SCHEMBL3240403 | 0.71 | MEN1 (0.46) | SIGMAR1MC4RACHEMEN1KMT2A | |
| SCHEMBL17618300 | 0.70 | SIGMAR1 (0.50) | SIGMAR1ADRA1DADRA1AADRA1BMC4R |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2215064-A1 | COMPOUNDS FOR INHIBITING KSP KINESIN ACTIVITY | Schering Corporation (US) | 2010-08-11 | — | — | EP | disclosed |
| WO-2009061596-A1 | COMPOUNDS FOR INHIBITING KSP KINESIN ACTIVITY | SCHERING CORPORATION (US) | 2009-05-14 | — | — | WO | disclosed |