Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 5/20 | 0.43 |
| ▸ | IDO1 | P14902 | 2/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | HTR2A | P28223 | 1/20 | 0.41 |
| ▸ | ABAT | P80404 | 1/20 | 0.41 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.41 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.39 |
| ▸ | BRAF | P15056 | 1/20 | 0.37 |
| ▸ | DDR1 | Q08345 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | F10 | P00742 | 2/20 | 0.36 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.35 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.35 |
| ▸ | ROCK1 | Q13464 | 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 | |
|---|---|---|---|---|
| SCHEMBL3770718 | 0.85 | KCNH2 (0.45) | KCNH2IDO1CYP2C9HTR2AABAT | |
| SCHEMBL3770903 | 0.83 | CHRM3 (0.48) | DDR1 | |
| SCHEMBL3777728 | 0.82 | KCNH2 (0.51) | KCNH2IDO1CYP2C9HTR2AABAT | |
| SCHEMBL15967357 | 0.80 | ENPP2 (0.35) | KCNH2ENPP2SIGMAR1 | |
| SCHEMBL3783226 | 0.77 | CCR2 (0.49) | KCNH2 | |
| SCHEMBL3776499 | 0.76 | CACNA1H (0.49) | KCNH2IDO1CYP2C9CACNA1H | |
| SCHEMBL712198 | 0.73 | SSTR4 (0.46) | KCNH2IDO1CYP2C9CACNA1HCYP3A4 | |
| SCHEMBL5507358 | 0.73 | TAS1R3 (0.52) | DDR1 | |
| SCHEMBL5506742 | 0.73 | TAS1R3 (0.49) | DDR1 | |
| SCHEMBL3773452 | 0.72 | TOP2A (0.44) | KCNH2IDO1CYP2C9CYP3A4F10 |
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-1869019-B1 | BICYCLIC [3.1.0] HETEROARYL AMIDES AS TYPE I GLYCINE TRANSPORT INHIBITORS | PFIZER PROD INC (US) | 2014-08-27 | — | — | EP | claimed |