Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA9 | Q16790 | 6/20 | 0.58 |
| ▸ | CA12 | O43570 | 5/20 | 0.58 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | GSTO1 | P78417 | 1/20 | 0.46 |
| ▸ | FABP4 | P15090 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | RECQL | P46063 | 1/20 | 0.44 |
| ▸ | IKBKB | O14920 | 1/20 | 0.43 |
| ▸ | CHUK | O15111 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | LPAR2 | Q9HBW0 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 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 | |
|---|---|---|---|---|
| SCHEMBL617098 | 0.85 | CA12 (0.79) | CA9CA12MAPK1ALDH1A1KDM4E | |
| SCHEMBL28854350 | 0.79 | CA9 (0.62) | CA9CA12MAPK1ALDH1A1KDM4E | |
| SCHEMBL1923940 | 0.79 | CA12 (0.71) | CA9CA12MAPK1ALDH1A1KDM4E | |
| SCHEMBL9307534 | 0.76 | MAPK1 (0.65) | CA9CA12MAPK1ALDH1A1KDM4E | |
| SCHEMBL28233948 | 0.76 | TSHR (0.47) | CA9CA12ALDH1A1KDM4EHSD17B10 | |
| SCHEMBL6568078 | 0.75 | MAPK1 (0.90) | MAPK1ALDH1A1KDM4EHPGDSMN1; SMN2 | |
| SCHEMBL8062917 | 0.75 | CA9 (0.74) | CA9CA12ALDH1A1HPGDRECQL | |
| SCHEMBL3336990 | 0.73 | CA12 (1.00) | CA9CA12ALDH1A1KDM4ESMN1; SMN2 | |
| SCHEMBL3827068 | 0.73 | CYP1A2 (0.58) | CA9CA12ALDH1A1KDM4EHSD17B10 | |
| SCHEMBL5167135 | 0.73 | CA12 (0.77) | CA9CA12MAPK1ALDH1A1CA1 |
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-1937652-A1 | PYRIMIDINE AMIDE COMPOUNDS AS PGDS INHIBITORS | Aventis Pharmaceuticals Inc. (US) | 2008-07-02 | — | — | EP | disclosed |
| WO-2007041634-A1 | PYRIMIDINE AMIDE COMPOUNDS AS PGDS INHIBITORS | AVENTIS PHARMACEUTICALS INC. (US) | 2007-04-12 | — | — | WO | disclosed |