Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD4 | P21917 | 3/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.58 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.58 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.58 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.58 |
| ▸ | DRD2 | P14416 | 1/20 | 0.58 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.58 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.58 |
| ▸ | ACHE | P22303 | 1/20 | 0.58 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.58 |
| ▸ | HTR2A | P28223 | 1/20 | 0.58 |
| ▸ | HTR2C | P28335 | 1/20 | 0.58 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.58 |
| ▸ | DRD3 | P35462 | 1/20 | 0.58 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.58 |
| ▸ | HTR2B | P41595 | 1/20 | 0.58 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.58 |
| ▸ | HTR3A | P46098 | 1/20 | 0.58 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.58 |
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 SCHEMBL11551725 | 0.98 | DRD4 (0.56) | DRD4CYP3A4CYP1A2ADRA2ACYP2D6 | |
| SCHEMBL11543452 | 0.93 | HTR4 (0.69) | DRD4CYP3A4CYP1A2ADRA2ACYP2D6 | |
| SCHEMBL11550058 | 0.93 | CYP3A4 (0.54) | DRD4CYP3A4CYP1A2ADRA2ACYP2D6 | |
| Hydrochloric Acid SCHEMBL11548712 | 0.92 | CYP3A4 (0.54) | DRD4CYP3A4CYP1A2ADRA2ACYP2D6 | |
| Hydrochloric Acid SCHEMBL11545633 | 0.91 | HTR4 (0.67) | DRD4CYP3A4CYP1A2ADRA2ACYP2D6 | |
| SCHEMBL9865649 | 0.89 | DRD2 (0.57) | DRD4CYP3A4CYP1A2ADRA2ACYP2D6 | |
| Hydrochloric Acid SCHEMBL9866290 | 0.89 | DRD2 (0.56) | DRD4CYP3A4CYP1A2ADRA2ACYP2D6 | |
| SCHEMBL11552522 | 0.85 | DRD2 (0.52) | DRD4CYP3A4CYP1A2ADRA2ACYP2D6 | |
| SCHEMBL11545625 | 0.84 | L3MBTL1 (0.47) | DRD4CYP3A4CYP1A2ADRA2ACYP2D6 | |
| SCHEMBL11544379 | 0.84 | DRD2 (0.54) | DRD4CYP3A4CYP1A2ADRA2ACYP2D6 |
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-4163789-A | Anti-psychotic (cycloalkenylalkylpiperidino) benzamides | ANPHAR, S.A. (ES) | 1979-08-07 | — | — | US | claimed |