Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 7/20 | 0.51 |
| ▸ | DRD3 | P35462 | 7/20 | 0.51 |
| ▸ | DRD4 | P21917 | 6/20 | 0.51 |
| ▸ | DRD2 | P14416 | 8/20 | 0.48 |
| ▸ | HTR2A | P28223 | 4/20 | 0.48 |
| ▸ | HTR7 | P34969 | 4/20 | 0.48 |
| ▸ | ADRA2C | P18825 | 3/20 | 0.48 |
| ▸ | DRD1 | P21728 | 3/20 | 0.48 |
| ▸ | DRD5 | P21918 | 3/20 | 0.48 |
| ▸ | HRH1 | P35367 | 3/20 | 0.48 |
| ▸ | SIGMAR1 | Q99720 | 7/20 | 0.47 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.46 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.46 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | HTR2C | P28335 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL9130259 | 0.88 | SIGMAR1 (0.44) | HTR1ADRD3DRD4DRD2HTR2A | |
| SCHEMBL9134820 | 0.86 | KDM4E (0.45) | HTR1ADRD2HTR2AHTR7LMNA | |
| SCHEMBL9131769 | 0.85 | DRD2 (0.44) | HTR1ADRD3DRD4DRD2HTR2A | |
| SCHEMBL11668436 | 0.84 | KMT2A (0.39) | CYP1A2CYP2D6 | |
| SCHEMBL10752570 | 0.84 | HTR1A (0.54) | HTR1ADRD3DRD4DRD2HTR2A | |
| SCHEMBL11674004 | 0.81 | SIGMAR1 (0.42) | HTR1ADRD3DRD4DRD2HTR7 | |
| SCHEMBL11072336 | 0.79 | PARP1 (0.42) | HTR1AHTR7SIGMAR1 | |
| SCHEMBL11224396 | 0.78 | SLC6A4 (0.41) | HTR1ADRD3HTR2ADRD1HRH1 | |
| SCHEMBL11223955 | 0.77 | SLC6A4 (0.41) | HTR1ADRD3HTR2ADRD1HRH1 | |
| SCHEMBL11071375 | 0.76 | DRD2 (0.53) | HTR1ADRD3DRD4DRD2HTR2A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5436337-A | Anticarcinogenic agents | THE UPJOHN COMPANY (US) | 1995-07-25 | — | — | US | disclosed |
| EP-0579754-A1 | USE OF AMINES TO SENSITIZE MULTIDRUG-RESISTANT CELLS | THE UPJOHN COMPANY (US) | 1994-01-26 | — | — | EP | disclosed |
| WO-1992018089-A2 | USE OF STEROIDAL AND NON-STEROIDAL AMINES TO SENSITIZE MULTIDRUG-RESISTANT CELLS | THE UPJOHN COMPANY (US) | 1992-10-29 | — | — | WO | disclosed |