Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 2/20 | 0.51 |
| ▸ | DRD2 | P14416 | 2/20 | 0.48 |
| ▸ | DRD3 | P35462 | 2/20 | 0.48 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.48 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.48 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.48 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.48 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.48 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 4/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.47 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.47 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.47 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
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 SCHEMBL10870609 | 0.99 | HTR2A (0.50) | HTR2ADRD2DRD3ADRA2AADRA2B | |
| SCHEMBL10873091 | 0.90 | SMN1; SMN2 (0.49) | HTR2ADRD2DRD3ADRA2AADRA2B | |
| SCHEMBL10873341 | 0.89 | HTR2A (0.54) | HTR2ADRD2DRD3ADRA2AADRA2B | |
| SCHEMBL10872305 | 0.86 | MTNR1A (0.50) | HTR2AMEN1KMT2AHTR1ASLC6A4 | |
| SCHEMBL10871284 | 0.86 | HTR2A (0.60) | HTR2AMEN1KMT2AHPGDALDH1A1 | |
| Bromide SCHEMBL10872043 | 0.86 | HTR7 (0.48) | HTR2AMEN1KMT2AHPGDALDH1A1 | |
| SCHEMBL10872139 | 0.84 | HTR2A (0.51) | HTR2ADRD2DRD3ADRA2AADRA2B | |
| SCHEMBL10871232 | 0.81 | HTR2A (0.50) | HTR2ADRD2DRD3ADRA2AADRA2B | |
| SCHEMBL10867950 | 0.80 | HTR2A (0.49) | HTR2ADRD2DRD3ADRA2AADRA2B | |
| Hydrochloric Acid SCHEMBL10867806 | 0.80 | HTR2A (0.49) | HTR2ADRD2DRD3ADRA2AADRA2B |
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-0187619-A2 | 1,3-Disubstituted tetrahydropyridines | CIBA-GEIGY AG (CH) | 1986-07-16 | — | — | EP | disclosed |
| EP-0187122-A2 | 1,3,4-Trisubstituted azacycloalkanes or azacycloalkenes | CIBA-GEIGY AG (CH) | 1986-07-09 | — | — | EP | disclosed |