Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.40 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.40 |
| ▸ | GUSB | P08236 | 11/20 | 0.40 |
| ▸ | MAOB | P27338 | 1/20 | 0.38 |
| ▸ | POLQ | O75417 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | BLM | P54132 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.36 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL15698831 | 0.85 | EGFR (0.45) | GAAKDM4EALDH1A1ADORA2AADORA1 | |
| SCHEMBL20392937 | 0.80 | CRHR1 (0.38) | POLQGAAKDM4EALDH1A1KMT2A | |
| SCHEMBL17174285 | 0.80 | EGFR (0.37) | POLQGAAALDH1A1MEN1KMT2A | |
| SCHEMBL17178242 | 0.77 | DRD1 (0.46) | KDM4EALDH1A1MEN1KMT2A | |
| SCHEMBL20171985 | 0.73 | HSP90AB1 (0.43) | GAAKDM4EALDH1A1MEN1KMT2A | |
| SCHEMBL19371622 | 0.73 | DRD1 (0.54) | — | |
| SCHEMBL15698821 | 0.71 | DRD1 (0.46) | — | |
| SCHEMBL15667386 | 0.71 | ESR1 (0.53) | ESR1ESR2GUSBMAOBGAA | |
| SCHEMBL9623648 | 0.69 | MAOB (0.67) | ESR1ESR2GUSBMAOBGAA | |
| SCHEMBL17416877 | 0.69 | ALDH1A1 (0.42) | POLQGAAKDM4EALDH1A1MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2917219-B1 | HETEROAROMATIC COMPOUNDS AND THEIR USE AS DOPAMINE D1 LIGANDS | PFIZER (US) | 2017-09-27 | — | — | EP | disclosed |