Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 1/20 | 0.49 |
| ▸ | DRD4 | P21917 | 1/20 | 0.49 |
| ▸ | RXRA | P19793 | 1/20 | 0.47 |
| ▸ | RXRB | P28702 | 1/20 | 0.47 |
| ▸ | RXRG | P48443 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | FFAR1 | O14842 | 7/20 | 0.43 |
| ▸ | ACHE | P22303 | 3/20 | 0.42 |
| ▸ | FFAR4 | Q5NUL3 | 4/20 | 0.42 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL7392253 | 0.91 | KDM4E (0.57) | RXRARXRBRXRGKDM4EMAPT | |
| SCHEMBL9325697 | 0.84 | DRD2 (0.51) | DRD2DRD4RXRARXRBRXRG | |
| SCHEMBL19410072 | 0.80 | PPID (0.54) | RXRARXRBRXRGFFAR1ACHE | |
| SCHEMBL5781914 | 0.79 | CPA3 (0.51) | DRD2DRD4KDM4EMAPTACHE | |
| SCHEMBL19421469 | 0.79 | PPID (0.42) | RXRARXRBRXRGFFAR1ACHE | |
| Hydrochloric Acid SCHEMBL19410080 | 0.79 | PPID (0.53) | RXRARXRBRXRGFFAR1ACHE | |
| SCHEMBL6046540 | 0.79 | ALDH1A1 (0.49) | KDM4EMAPTFFAR1FFAR4KEAP1 | |
| SCHEMBL11767335 | 0.79 | MAOA (0.50) | DRD2DRD4 | |
| Hydrochloric Acid SCHEMBL20509927 | 0.78 | RXRA (0.50) | DRD2RXRARXRBRXRGFFAR1 | |
| SCHEMBL23217085 | 0.77 | KDM4E (0.55) | DRD2DRD4KDM4EMAPTACHE |
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-2003011815-A1 | BICYCLIC HETEROAROMATIC ALANINES | CELLTECH R & D LIMITED (GB) | 2003-02-13 | — | — | WO | disclosed |