Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 3/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.47 |
| ▸ | KCNN4 | O15554 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | CRHBP | P24387 | 1/20 | 0.37 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.37 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.37 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.36 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL27484323 | 0.82 | CYP2D6 (0.50) | CYP2D6CYP1A2KCNN4ALDH1A1CYP2C19 | |
| SCHEMBL28327278 | 0.82 | CYP2D6 (0.55) | CYP2D6CYP1A2KCNN4ALDH1A1CYP2C19 | |
| SCHEMBL9363854 | 0.82 | CYP2D6 (0.55) | CYP2D6CYP1A2KCNN4ALDH1A1CYP2C19 | |
| Hydrochloric Acid SCHEMBL28058934 | 0.80 | CYP2D6 (0.53) | CYP2D6CYP1A2KCNN4ALDH1A1CYP2C19 | |
| SCHEMBL13951979 | 0.80 | CYP2D6 (0.48) | CYP2D6CYP1A2KCNN4ALDH1A1CYP2C19 | |
| SCHEMBL6680720 | 0.77 | ALDH1A1 (0.42) | CYP2D6CYP1A2ALDH1A1CYP2C19HSD17B10 | |
| SCHEMBL28024684 | 0.77 | CYP2D6 (0.46) | CYP2D6CYP1A2KCNN4ALDH1A1CYP2C19 | |
| SCHEMBL15228150 | 0.73 | KCNN4 (0.46) | CYP2D6CYP1A2KCNN4ALDH1A1CYP2C19 | |
| SCHEMBL16539034 | 0.72 | ADRA2C (0.42) | CYP2D6CYP1A2KCNN4ALDH1A1CYP2C19 | |
| SCHEMBL4352236 | 0.72 | MAPK1 (0.44) | CYP2D6CYP1A2KCNN4ALDH1A1CYP2C19 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1112275-B9 | NOVEL HETEROAROMATIC INHIBITORS OF FRUCTOSE 1,6-BISPHOSPHATASE | METABASIS THERAPEUTICS INC (US) | 2004-03-10 | — | — | EP | disclosed |
| EP-1112275-B1 | NOVEL HETEROAROMATIC INHIBITORS OF FRUCTOSE 1,6-BISPHOSPHATASE | METABASIS THERAPEUTICS INC (US) | 2003-07-30 | — | — | EP | disclosed |
| EP-1112275-A1 | NOVEL HETEROAROMATIC INHIBITORS OF FRUCTOSE 1,6-BISPHOSPHATASE | Metabasis Therapeutics, Inc. (US) | 2001-07-04 | — | — | EP | disclosed |
| WO-2000014095-A1 | NOVEL HETEROAROMATIC INHIBITORS OF FRUCTOSE 1,6-BISPHOSPHATASE | METABASIS THERAPEUTICS, INC. (US) | 2000-03-16 | — | — | WO | disclosed |