Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD4 | P21917 | 7/20 | 0.56 |
| ▸ | DRD2 | P14416 | 6/20 | 0.55 |
| ▸ | DRD3 | P35462 | 5/20 | 0.55 |
| ▸ | HTR3A | P46098 | 3/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.55 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.55 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.55 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.55 |
| ▸ | HTR2A | P28223 | 2/20 | 0.55 |
| ▸ | HTR2C | P28335 | 2/20 | 0.55 |
| ▸ | HTR2B | P41595 | 2/20 | 0.55 |
| ▸ | ACHE | P22303 | 2/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.55 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.55 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.55 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.55 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.55 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.55 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.55 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL6236267 | 0.99 | DRD4 (0.55) | DRD4DRD2DRD3HTR3ACYP3A4 | |
| SCHEMBL6234223 | 0.87 | ADRA2A (0.50) | HTR3AADRA2AADRA2BADRA2CHTR2A | |
| Hydrochloric Acid SCHEMBL6232454 | 0.86 | ADRA2A (0.49) | HTR3AADRA2AADRA2BADRA2CHTR2A | |
| SCHEMBL7243555 | 0.86 | DRD4 (0.73) | DRD4DRD2DRD3HTR3ACYP3A4 | |
| SCHEMBL6266458 | 0.84 | ADRA2A (0.48) | HTR3AADRA2AADRA2BADRA2CHTR2A | |
| Hydrochloric Acid SCHEMBL6268711 | 0.84 | ADRA2A (0.47) | HTR3AADRA2AADRA2BADRA2CHTR2A | |
| Hydrochloric Acid SCHEMBL6237211 | 0.82 | ADRA2A (0.51) | HTR3AADRA2AADRA2BADRA2CHTR2A | |
| SCHEMBL4888712 | 0.81 | DRD4 (0.55) | DRD4DRD2DRD3HTR3ACYP3A4 | |
| SCHEMBL4888708 | 0.81 | DRD4 (0.55) | DRD4DRD2DRD3HTR3ACYP3A4 | |
| SCHEMBL6238770 | 0.81 | ADRA2A (0.49) | HTR3AADRA2AADRA2BADRA2CHTR2A |
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-2005007600-A2 | NOVEL METHODS USING AMINOBENZOIC ACID COMPOUNDS | EISAI CO., LTD. (JP) | 2005-01-27 | — | — | WO | disclosed |