Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD1 | P21728 | 20/20 | 0.79 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.52 |
| ▸ | ADRB1 | P08588 | 2/20 | 0.52 |
| ▸ | HTR1A | P08908 | 2/20 | 0.52 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.52 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.52 |
| ▸ | DRD2 | P14416 | 2/20 | 0.52 |
| ▸ | DRD4 | P21917 | 2/20 | 0.52 |
| ▸ | DRD5 | P21918 | 2/20 | 0.52 |
| ▸ | HRH2 | P25021 | 2/20 | 0.52 |
| ▸ | HTR1D | P28221 | 2/20 | 0.52 |
| ▸ | HTR1B | P28222 | 2/20 | 0.52 |
| ▸ | HTR2A | P28223 | 2/20 | 0.52 |
| ▸ | HTR1E | P28566 | 2/20 | 0.52 |
| ▸ | HTR7 | P34969 | 2/20 | 0.52 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.52 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.52 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.52 |
| ▸ | DRD3 | P35462 | 2/20 | 0.52 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL19371553 | 0.89 | DRD1 (1.00) | DRD1CHRM2ADRB1HTR1AADRA2A | |
| SCHEMBL19371703 | 0.84 | DRD1 (0.65) | DRD1CHRM2ADRB1HTR1AADRA2A | |
| SCHEMBL19371577 | 0.84 | DRD1 (0.61) | DRD1CHRM2ADRB1HTR1AADRA2A | |
| SCHEMBL17074079 | 0.82 | DRD1 (0.68) | DRD1CHRM2ADRB1HTR1AADRA2A | |
| SCHEMBL19371621 | 0.81 | DRD1 (0.65) | DRD1CHRM2ADRB1HTR1AADRA2A | |
| SCHEMBL15688307 | 0.81 | DRD1 (0.60) | DRD1CHRM2ADRB1HTR1AADRA2A | |
| SCHEMBL15688106 | 0.79 | DRD1 (0.81) | DRD1CHRM2ADRB1HTR1AADRA2A | |
| SCHEMBL19371550 | 0.79 | DRD1 (0.81) | DRD1CHRM2ADRB1HTR1AADRA2A | |
| SCHEMBL17178235 | 0.77 | ALDH1A1 (0.55) | DRD1 | |
| SCHEMBL19371622 | 0.76 | DRD1 (0.54) | DRD1CHRM2ADRB1HTR1AADRA2A |
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-3323821-A1 | HETEROAROMATIC COMPOUNDS AND THEIR USE AS DOPAMINE D1 LIGANDS | Pfizer Inc (US) | 2018-05-23 | — | — | EP | disclosed |
| EP-2917219-B1 | HETEROAROMATIC COMPOUNDS AND THEIR USE AS DOPAMINE D1 LIGANDS | PFIZER (US) | 2017-09-27 | — | — | EP | disclosed |