Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | MEP1B | Q16820 | 1/20 | 0.33 |
| ▸ | MRGPRX1 | Q96LB2 | 1/20 | 0.33 |
| ▸ | IDO1 | P14902 | 1/20 | 0.33 |
| ▸ | DRD2 | P14416 | 1/20 | 0.33 |
| ▸ | DRD1 | P21728 | 1/20 | 0.33 |
| ▸ | DRD4 | P21917 | 1/20 | 0.33 |
| ▸ | DRD5 | P21918 | 1/20 | 0.33 |
| ▸ | DRD3 | P35462 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL2990470 | 0.84 | CA1 (0.49) | CA1CA2CA9L3MBTL1ALDH1A1 | |
| SCHEMBL6942043 | 0.81 | CA1 (0.44) | CA1CA2CA9HTTL3MBTL1 | |
| SCHEMBL31204254 | 0.79 | CA1 (0.46) | MRGPRX4CA1CA2CA9L3MBTL1 | |
| SCHEMBL1411728 | 0.79 | CA1 (0.46) | MRGPRX4CA1CA2CA9L3MBTL1 | |
| SCHEMBL4581096 | 0.79 | ACHE (0.55) | CA1CA2CA9L3MBTL1MCOLN3 | |
| SCHEMBL1997201 | 0.78 | TDP1 (0.44) | KDM4EALDH1A1DRD2DRD1DRD4 | |
| SCHEMBL31195498 | 0.78 | CA1 (0.44) | MRGPRX4CA1CA2CA9KDM4E | |
| SCHEMBL12432000 | 0.78 | PTGDR2 (0.33) | CA1CA2CA9TP53ALDH1A1 | |
| SCHEMBL2989290 | 0.78 | CA1 (0.44) | MRGPRX4CA1CA2CA9KDM4E | |
| SCHEMBL29414132 | 0.78 | TDP1 (0.44) | KDM4EALDH1A1DRD2DRD1DRD4 |
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-2014119617-A1 | AMIDINE COMPOUND AND SALT THEREOF | 富山化学工業株式会社 (JP) | 2014-08-07 | — | — | WO | disclosed |