Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.38 |
| ▸ | CYP2A6 | P11509 | 3/20 | 0.38 |
| ▸ | DRD3 | P35462 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | PGR | P06401 | 1/20 | 0.37 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.37 |
| ▸ | HTR1A | P08908 | 1/20 | 0.37 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.37 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.37 |
| ▸ | AR | P10275 | 1/20 | 0.37 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.37 |
| ▸ | IDO1 | P14902 | 1/20 | 0.37 |
| ▸ | DRD1 | P21728 | 1/20 | 0.37 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.37 |
| ▸ | ACHE | P22303 | 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 | |
|---|---|---|---|---|
| SCHEMBL4664840 | 0.83 | CYP2A6 (0.39) | CYP1A2CYP2A6DRD3LMNACYP3A4 | |
| SCHEMBL2090742 | 0.81 | CYP2A6 (0.38) | CYP1A2CYP2A6DRD3LMNACYP3A4 | |
| SCHEMBL3985620 | 0.81 | CYP2A6 (0.38) | CYP1A2CYP2A6DRD3LMNACYP3A4 | |
| SCHEMBL8587770 | 0.79 | TAAR1 (0.50) | CYP1A2CYP2A6DRD3LMNACYP3A4 | |
| SCHEMBL17038612 | 0.78 | F2RL1 (0.36) | CYP2A6LMNASLC6A4MIFGABRA1 | |
| SCHEMBL6299526 | 0.78 | GABRA1 (0.42) | CYP1A2CYP2A6CYP2D6CYP2C19GABRA1 | |
| SCHEMBL29908309 | 0.75 | CYP2A6 (0.42) | CYP1A2CYP2A6MIFMCL1GAA | |
| SCHEMBL787846 | 0.75 | CYP2A6 (0.42) | CYP1A2CYP2A6MIFMCL1GAA | |
| SCHEMBL6305533 | 0.74 | CLCN2 (0.43) | LMNACYP2C9TDP1MEN1RAB9A | |
| SCHEMBL2091808 | 0.74 | CYP1A2 (0.34) | CYP1A2CYP2A6DRD3LMNACYP3A4 |
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-7323433-B2 | R-(-)-1-[2-(7-chlorobenzo[b]thiopen-3-yl-methoxy)-2-(2,4-dichlorophenyl)-ethyl]-1H-imidazole | FERRER INTERNACIONAL, S.A. (ES) | 2008-01-29 | — | — | US | disclosed |
| EP-1678185-A1 | 2,3-DIHYDRO-6-NITROIMIDAZO [2,1-B] OXAZOLE COMPOUNDS FOR THE TREATMENT OF TUBERCULOSIS | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 2006-07-12 | — | — | EP | disclosed |
| WO-2005042542-A1 | 2,3-DIHYDRO-6-NITROIMIDAZO (2,1-B) OXAZOLE COMPOUNDS FOR THE TREATMENT OF TUBERCULOSIS | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 2005-05-12 | — | — | WO | disclosed |